C28H46O
4a-Methylzymosterol
398.35486
6022
PubChem-compound
388357
ChemSpider
1.0
6.0
Farnesyl pyrophosphate
C23H38N7O17P3S
Acetyl-CoA
809.1258
ReactionCatalysis100849
ACTIVATION
ReactionCatalysis100848
ACTIVATION
937
ChemSpider
MEVALONATE
BioCyc
Unknown
1.0
388353
ChemSpider
ReactionCatalysis100850
ACTIVATION
CHOLESTEROL
BioCyc
C15808
KEGG Compound
HMDB0001188
HMDB
O88822
UniProt
C00448
KEGG Compound
389458
ChemSpider
3-hydroxy-3-methylglutaryl-coenzyme A reductase
HMDB0061374
HMDB
PW000054
PathWhiz
ReactionCatalysis100839
ACTIVATION
HMDB0061373
HMDB
ReactionCatalysis100838
ACTIVATION
ReactionCatalysis100837
ACTIVATION
1.0
111-02-4
CAS
NADPH
ATP
BioCyc
PW000051
PathWhiz
C15816
KEGG Compound
1.0
4a-Methylzymosterol
1.0
559142
ChemSpider
ReactionCatalysis100847
ACTIVATION
ReactionCatalysis100846
ACTIVATION
ReactionCatalysis100845
ACTIVATION
ReactionCatalysis100844
ACTIVATION
Mevalonic acid
Cholesterol
ReactionCatalysis100843
ACTIVATION
Fatty acid
ReactionCatalysis100842
ACTIVATION
ReactionCatalysis100841
ACTIVATION
CHEBI:28113
ChEBI
C11455
KEGG Compound
ReactionCatalysis100840
ACTIVATION
C30H50O
(S)-2,3-Epoxysqualene
426.38617
Lathosterol oxidase
CHEBI:16113
ChEBI
Cholesterol
C03845
KEGG Compound
1.0
5742
ChemSpider
C29H46O
4,4-Dimethylcholesta-8,14,24-trienol
410.35486
PW000163
PathWhiz
2.0
1.0
C00332
KEGG Compound
CHEBI:16474
ChEBI
952
ChemSpider
Carbon dioxide
1.0
EPOXYSQUALENE
BioCyc
(S)-2,3-Epoxysqualene
HMDB0001090
HMDB
389550
ChemSpider
C00341
KEGG Compound
7-Dehydrodesmosterol
CHEBI:17211
ChEBI
WW domain-containing oxidoreductase
445713
PubChem-compound
SMILES
CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCS
1.0
PPI
BioCyc
1.0
Lanosterol
WW domain-containing oxidoreductase
Mus musculus
Pyrophosphate
Lathosterol oxidase
UDP-glucuronic acid decarboxylase 1
UDP-glucuronic acid decarboxylase 1
Phosphomevalonate kinase
1.0
Water
SMILES
[H][C@@]1(CC=C2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3)[C@H](C)CCC=C(C)C
C00235
KEGG Compound
SMILES
CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C=C(/C)CC\C=C(/C)CC[C@@H]1OC1(C)C
C00356
KEGG Compound
CHEBI:16057
ChEBI
CHEBI:16290
ChEBI
C10H20O7P2
Geranyl-PP
314.06842
3-Keto-4-methylzymosterol
Cholesterol
C00009
KEGG Compound
C00008
KEGG Compound
C00129
KEGG Compound
1158
ChemSpider
Unknown
C00007
KEGG Compound
C00249
KEGG Compound
C00006
KEGG Compound
5-ALPHA-CHOLESTA-724-DIEN-3-BETA-OL
BioCyc
C5H12O7P2
Dimethylallylpyrophosphate
246.00583
CHEBI:18009
ChEBI
C29H48O
4,4-Dimethyl-5a-cholesta-8,24-dien-3-b-ol
412.3705
C00001
KEGG Compound
NADP
CHEBI:18361
ChEBI
P54869
UniProt
C00005
KEGG Compound
CHEBI:18367
ChEBI
1032
ChemSpider
CHEBI:18364
ChEBI
C00002
KEGG Compound
150-97-0
CAS
434-16-2
CAS
Geranyl-PP
57-88-5
CAS
388534
ChemSpider
1.14.21.6
false
1.14.21.6
Lathosterol + NADPH + Oxygen ↔ 7-Dehydrocholesterol + NADP + 2 Water
REVERSIBLE
1.3.1.72
false
1.3.1.72
7-Dehydrodesmosterol + NADPH ↔ 7-Dehydrocholesterol + NADP
REVERSIBLE
C01107
KEGG Compound
C30H50O
Lanosterol
426.38617
5.3.3.5
false
5.3.3.5
Lathosterol → 5a-Cholest-8-en-3b-ol
LEFT_TO_RIGHT
5.3.3.5
false
5.3.3.5
7-Dehydrocholesterol + NADPH → Cholesterol + NADP
LEFT_TO_RIGHT
ReactionCatalysis100829
ACTIVATION
1.0
ReactionCatalysis100828
ACTIVATION
ReactionCatalysis100827
ACTIVATION
ReactionCatalysis100826
ACTIVATION
763-10-0
CAS
SMILES
[H][C@@]1(CC[C@@]2([H])C3=CC[C@@]4([H])C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
Adenosine triphosphate
C00011
KEGG Compound
C00010
KEGG Compound
24,25-Dihydrolanosterol
388531
ChemSpider
Reaction109658
false
2 Acetyl-CoA ↔ Acetoacetyl-CoA + Coenzyme A
REVERSIBLE
C00013
KEGG Compound
3.0
2.0
NAD(P)
BioCyc
3-HYDROXY-3-METHYL-GLUTARYL-COA
BioCyc
ReactionCatalysis100836
ACTIVATION
1.14.13.72
false
1.14.13.72
4,4-Dimethyl-5a-cholesta-8,24-dien-3-b-ol + 3 NADPH + 3 Oxygen → 4a-Methylzymosterol-4-carboxylic acid + 3 NADP + 4 Water
LEFT_TO_RIGHT
ReactionCatalysis100835
ACTIVATION
1.1.1.170
false
1.1.1.170
4a-Methylzymosterol-4-carboxylic acid + NADP → 3-Keto-4-methylzymosterol + Carbon dioxide + NADPH
LEFT_TO_RIGHT
ReactionCatalysis100834
ACTIVATION
ReactionCatalysis100833
ACTIVATION
ReactionCatalysis100832
ACTIVATION
1.3.1.72
false
1.3.1.72
NADPH + Zymosterol intermediate 2 → 5a-Cholest-8-en-3b-ol + NADP
LEFT_TO_RIGHT
ReactionCatalysis100831
ACTIVATION
1.3.1.72
false
1.3.1.72
5a-Cholesta-7,24-dien-3b-ol + NADPH ↔ Lathosterol + NADP
REVERSIBLE
ReactionCatalysis100830
ACTIVATION
Reaction110522
false
3-Keto-4-methylzymosterol + NADPH → 4a-Methylzymosterol + NADP
LEFT_TO_RIGHT
5.3.3.5
false
5.3.3.5
Zymosterol intermediate 2 → 5a-Cholesta-7,24-dien-3b-ol
LEFT_TO_RIGHT
C6H14O10P2
(S)-5-Diphosphomevalonic acid
308.00623
Zymosterol intermediate 2
1.0
CHEBI:1949
ChEBI
445995
PubChem-compound
56-65-5
CAS
443212
PubChem-compound
5775
ChemSpider
388662
ChemSpider
C00024
KEGG Compound
44-DIMETHYL-CHOLESTA-812-24-TRIENOL
BioCyc
ReactionCatalysis100825
ACTIVATION
1.1.1.34
false
1.1.1.34
3-Hydroxy-3-methylglutaryl-CoA + NADPH → Coenzyme A + Mevalonic acid + NADP
LEFT_TO_RIGHT
ReactionCatalysis100824
ACTIVATION
2.3.1.26
false
2.3.1.26
Cholesterol + Fatty acid → Cholesterol Ester + Water
LEFT_TO_RIGHT
2.0
ReactionCatalysis100823
ACTIVATION
ReactionCatalysis100822
ACTIVATION
1.3.1.72
false
1.3.1.72
Desmosterol + NADPH ↔ Cholesterol + NADP
REVERSIBLE
65728
PubChem-compound
2.7.1.36
false
2.7.1.36
Adenosine triphosphate + Mevalonic acid → Adenosine diphosphate + Mevalonic acid-5P
LEFT_TO_RIGHT
CPD-499
BioCyc
647
PubChem-compound
388517
ChemSpider
2.7.4.2
false
2.7.4.2
Adenosine triphosphate + Mevalonic acid-5P → (S)-5-Diphosphomevalonic acid + Adenosine diphosphate
LEFT_TO_RIGHT
4.1.1.33
false
4.1.1.33
(S)-5-Diphosphomevalonic acid + Adenosine triphosphate → Adenosine diphosphate + Carbon dioxide + Isopentenyl pyrophosphate + Phosphate
LEFT_TO_RIGHT
C29H50O
4,4-Dimethyl-5a-cholesta-8-en-3b-ol
414.38617
372-97-4
CAS
C27H46O
5a-Cholest-8-en-3b-ol
386.35486
C27H44O
5a-Cholesta-7,24-dien-3b-ol
384.3392
59151
ChemSpider
HMDB0001343
HMDB
SMILES
CC(C)=CCC\C(C)=C/CC\C(C)=C\CC\C=C(/C)CC\C=C(/C)CCC=C(C)C
SMILES
CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N
Peroxisome
HMDB0000256
HMDB
Mevalonic acid-5P
Vitamin D3
HMDB0001347
HMDB
1.0
114943
ChemSpider
HMDB0000250
HMDB
SMILES
[O-]P([O-])(=O)OP([O-])([O-])=O
1.0
HMDB0001341
HMDB
GERANYL-PP
BioCyc
1.14.13.70
false
1.14.13.70
Lanosterol + 3 NADPH + 3 Oxygen → 4,4-Dimethylcholesta-8,14,24-trienol + Formic acid + 3 NADP + 4 Water
LEFT_TO_RIGHT
1.3.1.70
false
1.3.1.70
4,4-Dimethylcholesta-8,14,24-trienol + NADPH → 4,4-Dimethyl-5a-cholesta-8,24-dien-3-b-ol + NADP
LEFT_TO_RIGHT
5.4.99.7
false
5.4.99.7
(S)-2,3-Epoxysqualene → Lanosterol
LEFT_TO_RIGHT
1.3.1.72
false
1.3.1.72
Lanosterol + NADPH ↔ 24,25-Dihydrolanosterol + NADP
REVERSIBLE
1.3.1.72
false
1.3.1.72
4,4-Dimethyl-5a-cholesta-8,24-dien-3-b-ol + NADPH → 4,4-Dimethyl-5a-cholesta-8-en-3b-ol + NADP
LEFT_TO_RIGHT
SMILES
NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O
10148626
ChemSpider
HMDB0006927
HMDB
HMDB0003896
HMDB
SMILES
C[C@@](O)(CCOP(O)(O)=O)CC(O)=O
5.3.3.2
false
5.3.3.2
Isopentenyl pyrophosphate ↔ Dimethylallylpyrophosphate
REVERSIBLE
Mevalonic acid
Q9Z0M5
UniProt
2.5.1.21
false
2.5.1.21
2 Farnesyl pyrophosphate + NADPH → NADP + 2 Pyrophosphate + Squalene
LEFT_TO_RIGHT
1.14.13.132
false
1.14.13.132
NADPH + Oxygen + Squalene → (S)-2,3-Epoxysqualene + NADP + Water
LEFT_TO_RIGHT
1.0
Reaction110511
false
Dimethylallylpyrophosphate + Isopentenyl pyrophosphate → Geranyl-PP + Pyrophosphate
LEFT_TO_RIGHT
Reaction110512
false
Geranyl-PP + Isopentenyl pyrophosphate → Farnesyl pyrophosphate + Pyrophosphate
LEFT_TO_RIGHT
HMDB0000142
HMDB
C15H28O7P2
Farnesyl pyrophosphate
382.13104
53477723
PubChem-compound
7448-02-4
CAS
1.0
CHEBI:18252
ChEBI
C01143
KEGG Compound
7732-18-5
CAS
CHEBI:17168
ChEBI
1.0
C00058
KEGG Compound
436
ChemSpider
Water
9029-62-3
CAS
SMILES
[H][C@@](C)(CCC=C(C)C)[C@@]1([H])CC[C@@]2([H])C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@]1([H])CC3
SMILES
CC(O)(CCO)CC(O)=O
44-DIMETHYL-5ALPHA-CHOLEST-7-EN-3BET
BioCyc
FORMATE
BioCyc
Adenosine diphosphate
HMDB0001120
HMDB
SMILES
[H][C@@]1(CC[C@@]2([H])C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3)[C@H](C)CCCC(C)C
57-10-3
CAS
HMDB0001484
HMDB
HMDB0000032
HMDB
101770
PubChem-compound
CPD-4211
BioCyc
C10H16N5O13P3
Adenosine triphosphate
506.99576
Steroid Biosynthesis
CPD-4578
BioCyc
C00187
KEGG Compound
FARNESYL-PP
BioCyc
C27H42O
7-Dehydrodesmosterol
382.32358
2.3.3.10
false
2.3.3.10
Acetoacetyl-CoA + Acetyl-CoA + Water → 3-Hydroxy-3-methylglutaryl-CoA + Coenzyme A
LEFT_TO_RIGHT
Pyrophosphate
HMDB0001377
HMDB
70741-38-7
CAS
SMILES
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
30792004
ChemSpider
C28H44O
3-Keto-4-methylzymosterol
396.3392
C30H52O
24,25-Dihydrolanosterol
428.40182
HMDB0001251
HMDB
HMDB0001375
HMDB
962
PubChem-compound
7448-03-5
CAS
5800
ChemSpider
53477900
PubChem-compound
1.0
SMILES
CCCCCCCCCCCCCCCC(O)=O
SMILES
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCC4C3CC=C2C1)[C@H](C)CCCC(C)C
3-Hydroxy-3-methylglutaryl-CoA
CO2
Carbon dioxide
43.98983
C01164
KEGG Compound
1.0
2.0
PW064651
PathWhiz
Coenzyme A
SMILES
O=O
HMDB0006838
HMDB
1.0
HMDB0006839
HMDB
1.0
CHEBI:27910
ChEBI
Butyrate Metabolism
SubPathway
1.0
1.0
HMDB0002111
HMDB
SMILES
C[C@](O)(CC(O)=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N
HMDB0001023
HMDB
53477909
PubChem-compound
SMILES
OC=O
14265-44-2
CAS
Squalene
58-64-0
CAS
C01054
KEGG Compound
SMILES
C[C@@H](CCC=C(C)C)C1CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)(C1CC3)C(O)=O
C27H44O
Desmosterol
384.3392
HMDB0000067
HMDB
960
ChemSpider
Q91WL8
UniProt
1.0
1.0
HMDB0006840
HMDB
HMDB0006841
HMDB
HMDB0006842
HMDB
1.0
985
PubChem-compound
644102
PubChem-compound
444493
PubChem-compound
Unknown
C01189
KEGG Compound
SMILES
CC(=C)CCOP(O)(=O)OP(O)(O)=O
64-18-6
CAS
4,4-Dimethylcholesta-8,14,24-trienol
22833512
PubChem-compound
1.0
ACETYL-COA
BioCyc
1.0
H2O
Water
18.010565
22212495
PubChem-compound
1.0
HMDB0001285
HMDB
HMDB0001286
HMDB
SMP0063670
SMPDB
Lanosterol
977
PubChem-compound
ReactionCatalysis99918
ACTIVATION
C27H44O
Vitamin D3
384.3392
C05437
KEGG Compound
C05439
KEGG Compound
627
ChemSpider
1.0
Desmosterol
HMDB0002027
HMDB
8-Dehydrocholesterol
HMDB0001170
HMDB
Isopentenyl pyrophosphate
17215925
ChemSpider
4.0
Lysosomal acid lipase/cholesteryl ester hydrolase
Q9D1G2
UniProt
CPD-8621
BioCyc
C05443
KEGG Compound
CPD-4141
BioCyc
C27H44O
8-Dehydrocholesterol
384.3392
80-99-9
CAS
5a-Cholesta-7,24-dien-3b-ol
Valine, Leucine, and Isoleucine Degradation
SubPathway
4a-Methylzymosterol-4-carboxylic acid
C27H44O
Zymosterol intermediate 2
384.3392
SMILES
O
Reaction995
true
7-Dehydrocholesterol → Vitamin D3
LEFT_TO_RIGHT
Reaction996
true
7-Dehydrocholesterol → 8-Dehydrocholesterol
LEFT_TO_RIGHT
C6H12O4
Mevalonic acid
148.07356
Bile Acid Biosynthesis
SubPathway
SQUALENE
BioCyc
Fatty acid
HMDB0000538
HMDB
SMILES
[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)CCC1=C)[C@H](C)CCCC(C)C
92746
PubChem-compound
HMDB0002719
HMDB
1.0
Desmosterol
393270
ChemSpider
6816
PubChem-compound
Water
C27H46O
Cholesterol
386.35486
ADP
BioCyc
7-DEHYDRO-CHOLESTEROL
BioCyc
Dimethylallylpyrophosphate
1.0
10090
TAXONOMY
53-59-8
CAS
1553-55-5
CAS
Lysosome
SubPathwayInteraction57662
SubPathway57662Reaction
SubPathwayReaction
SubPathwayInteraction57663
SubPathway57663Reaction
SubPathwayReaction
358-72-5
CAS
SubPathwayInteraction57660
SubPathway57660Reaction
SubPathwayReaction
SubPathwayInteraction57661
SubPathway57661Reaction
SubPathwayReaction
C05107
KEGG Compound
1.0
C05109
KEGG Compound
C05108
KEGG Compound
5997
PubChem-compound
C05103
KEGG Compound
SMILES
[H][C@@](C)(CCCC(C)C)[C@@]1([H])CC[C@@]2([H])C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@]1([H])CC3
SMILES
[H][C@@](C)(CCC=C(C)C)[C@@]1([H])CC[C@@]2([H])C3=CC[C@@]4([H])C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
Cholesterol Ester
79-63-0
CAS
1.0
(S)-5-Diphosphomevalonic acid
3.0
278
ChemSpider
91952
ChemSpider
Fatty Acid Metabolism
SubPathway
274
ChemSpider
SubPathwayInteraction57666
SubPathway57666Reaction
SubPathwayReaction
SubPathwayInteraction57664
SubPathway57664Reaction
SubPathwayReaction
SubPathwayInteraction57665
SubPathwayReaction
SubPathway57665Reaction
Hydroxymethylglutaryl-CoA synthase, mitochondrial
CHEBI:505093
ChEBI
CPD-641
BioCyc
O4P
Phosphate
94.95342
Adenosine triphosphate
7-Dehydrocholesterol
Tryptophan Metabolism
SubPathway
25994967
ChemSpider
Pyruvate Metabolism
SubPathway
C21H30N7O17P3
NADPH
745.0911
Q91XL3
UniProt
C21H29N7O17P3
NADP
744.08325
C27H44O
7-Dehydrocholesterol
384.3392
Acetyl-CoA
SubPathwayOutput
SubPathwayInteraction57659
SubPathway57659Reaction
SubPathwayReaction
NADPH
BioCyc
449
PubChem-compound
Mevalonic acid-5P
50990081
PubChem-compound
C5H12O7P2
Isopentenyl pyrophosphate
246.00583
1.0
Sterol O-acyltransferase 2
CPD-6641
BioCyc
HMDB0001423
HMDB
SMILES
[O-]P([O-])([O-])=O
HMDB0000217
HMDB
Acetyl-CoA acetyltransferase, cytosolic
124-38-9
CAS
CHEBI:16608
ChEBI
GO:0005764
GENE ONTOLOGY
1.0
1.0
Oxygen
CHEBI:15899
ChEBI
HMDB0001429
HMDB
NADPH
SMILES
NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O
SMILES
[H][C@@]1(CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
HMDB0000221
HMDB
SMP0000051
SMPDB
Unknown
SMILES
NC(=O)C1=CN(C=CC1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H]2O[C@@H]([C@@H](OP(O)(O)=O)[C@H]2O)N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1O
5280795
PubChem-compound
Zymosterol intermediate 2
HMDB0000227
HMDB
393471
ChemSpider
53-57-6
CAS
CPD-8606
BioCyc
1.0
5a-Cholesta-7,24-dien-3b-ol
Reaction978
false
5a-Cholesta-7,24-dien-3b-ol → 7-Dehydrodesmosterol
LEFT_TO_RIGHT
1.0
SMILES
O=C=O
C45H80O2
Cholesterol Ester
652.61584
1.0
C16H32O2
Fatty acid
256.24023
O7P2
Pyrophosphate
173.91193
CHEBI:28940
ChEBI
C25H40N7O18P3S
Acetoacetyl-CoA
851.13635
4-METHYL-824-CHOLESTADIENOL
BioCyc
1.0
SMP0000060
SMPDB
Steroidogenesis
SubPathway
Acetoacetyl-CoA
SubPathwayOutput
1.0
HMDB0001206
HMDB
5957
PubChem-compound
1.0
439418
PubChem-compound
Reaction971
true
4a-Methylzymosterol → Zymosterol intermediate 2
LEFT_TO_RIGHT
C30H50
Squalene
410.39127
Cholesterol
SubPathwayInput
SMP0000063
SMPDB
1.0
7-Dehydrocholesterol
1.0
1.0
CHEBI:17813
ChEBI
Reaction989
false
7-Dehydrodesmosterol → Desmosterol
LEFT_TO_RIGHT
CHEBI:15756
ChEBI
1.0
(S)-2,3-Epoxysqualene
2.0
439400
PubChem-compound
Cholesterol Ester
SMP0000073
SMPDB
C10H15N5O10P2
Adenosine diphosphate
427.02942
GO:0005737
GENE ONTOLOGY
5a-Cholest-8-en-3b-ol
C6H13O7P
Mevalonic acid-5P
228.03989
79-62-9
CAS
HMDB0001217
HMDB
Lathosterol
Coenzyme A
4,4-Dimethyl-5a-cholesta-8-en-3b-ol
SMILES
[H][C@@]12CC[C@H]([C@H](C)CCC=C(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C
ReactionCatalysis100147
ACTIVATION
C01802
KEGG Compound
2.0
Endoplasmic Reticulum
Endoplasmic Reticulum Membrane
CPD-8587
BioCyc
Lysosomal acid lipase/cholesteryl ester hydrolase
Hydroxymethylglutaryl-CoA synthase, mitochondrial
CHEBI:15441
ChEBI
7-Dehydrodesmosterol
CHEBI:15440
ChEBI
SMILES
[H][C@@]1(CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3)[C@H](C)CCC=C(C)C
CHEBI:1146900
ChEBI
1.0
1.0
1.0
4a-Methylzymosterol
14000-31-8
CAS
CHEBI:17759
ChEBI
CO-A
BioCyc
Adenosine diphosphate
1.0
LANOSTEROL
BioCyc
5675
ChemSpider
72-89-9
CAS
216175
ChemSpider
SMILES
C[C@@](O)(CCOP(O)(=O)OP(O)(O)=O)CC(O)=O
C21H36N7O16P3S
Coenzyme A
767.11523
439423
PubChem-compound
18971002
PubChem-compound
Cytoplasm
1.0
Geranylgeranyl pyrophosphate synthase
SMP0000130
SMPDB
4,4-Dimethyl-5a-cholesta-8,24-dien-3-b-ol
ACETOACETYL-COA
BioCyc
83724
ChemSpider
1.0
CHEBI:15422
ChEBI
6557
ChemSpider
SMILES
CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N
SMILES
[H][C@@]1(CC[C@@]2([H])C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@@H](C)[C@]1([H])CC3)[C@H](C)CCC=C(C)C
1.0
C27H44N7O20P3S
3-Hydroxy-3-methylglutaryl-CoA
911.1575
CHEBI:25351
ChEBI
23724604
PubChem-compound
Farnesyl pyrophosphate synthase
O2
Oxygen
31.98983
CH2O2
Formic acid
46.005478
439214
PubChem-compound
439577
PubChem-compound
440560
PubChem-compound
GO:0005789
GENE ONTOLOGY
1.0
Isopentenyl pyrophosphate
GO:0005783
GENE ONTOLOGY
439218
PubChem-compound
CHEBI:16521
ChEBI
Water
391478
ChemSpider
1.0
CHEBI:17737
ChEBI
Unknown
CHEBI:16526
ChEBI
C29H46O3
4a-Methylzymosterol-4-carboxylic acid
442.3447
1.0
440558
PubChem-compound
73566-35-5
CAS
CHEBI:16761
ChEBI
7782-44-7
CAS
1.0
HMDB0000961
HMDB
246983
PubChem-compound
440670
PubChem-compound
1.0
GO:0005777
GENE ONTOLOGY
Dimethylallylpyrophosphate
SMP0000035
SMPDB
SMP0000032
SMPDB
1.0
PW000145
PathWhiz
Farnesyl pyrophosphate
C01724
KEGG Compound
HMDB0006271
HMDB
PW000023
PathWhiz
358-71-4
CAS
Sterol O-acyltransferase 2
4444353
ChemSpider
392413
ChemSpider
(S)-5-Diphosphomevalonic acid
C27H46O
Lathosterol
386.35486
1715-86-2
CAS
1.0
1.0
PW000141
PathWhiz
Phosphomevalonate kinase
C00751
KEGG Compound
CPD-4186
BioCyc
SMILES
[H]OP(=O)(O[H])OP(=O)(O[H])OC\C=C(/C)CC\C=C(/C)CCC=C(C)C
CHEBI:30751
ChEBI
128-33-6
CAS
3-Hydroxy-3-methylglutaryl-CoA
1420-36-6
CAS
CHEBI:15377
ChEBI
CHEBI:17436
ChEBI
CHEBI:15379
ChEBI
PW000014
PathWhiz
O88908
UniProt
SMILES
NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O
5886
PubChem-compound
1.0
1.0
Phosphate
CHEBI:16584
ChEBI
SMILES
[H][C@@]1(CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC=C(C)C
SMILES
C[C@H](CCC=C(C)C)C1CCC2C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)C1CC3
SMILES
[H][C@@](C)(CCCC(C)C)[C@@]1([H])CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3
3.0
SMILES
[H][C@@](C)(CCCC(C)C)[C@@]1([H])CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])CC3
280
PubChem-compound
1.0
Carbon dioxide
1.0
30776536
ChemSpider
CHEBI:15467
ChEBI
CHEBI:15345
ChEBI
1195
PubChem-compound
CHEBI:17407
ChEBI
C00418
KEGG Compound
1.0
566-97-2
CAS
389460
ChemSpider
SMILES
[H][C@@]12CCC([C@H](C)CCC=C(C)C)[C@@]1(C)CCC1=C2CC[C@@]2([H])C(C)(C)[C@@H](O)CC[C@]12C
SMILES
CC(C)=CCC\C(C)=C\CO[P@@](=O)(O)OP(=O)(O)O
1.0
20036827
ChemSpider
HMDB0000876
HMDB
NADP
1061
PubChem-compound
1.0
129846
PubChem-compound
HMDB0001967
HMDB
651-54-7
CAS
64284-64-6
CAS
Formic acid
SMILES
CC(C)=CCO[P@](O)(=O)OP(O)(O)=O
CHEBI:15351
ChEBI
C15915
KEGG Compound
85-61-0
CAS
313-04-2
CAS
67-97-0
CAS
11975273
PubChem-compound