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32-hydroxylanosterol

PropertiesImage
MNX_IDMNXM6860 Image of MNXM6860
referencechebi:166806
formulaC30H50O2
global charge0
mol weight442.728
InChIKeyDWVYYKFZEDMMPU-PUXRVUTHSA-N
InChIInChI=1S/C30H50O2/c1-20(2)9-8-10-21(3)22-14-18-30(19-31)24-11-12-25-27(4,5)26(32)15-16-28(25,6)23(24)13-17-29(22,30)7/h9,21-22,25-26,31-32H,8,10-19H2,1-7H3/t21-,22-,25+,26+,28-,29-,30-/m1/s1
SMILESCC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(CO)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
MNX internals
InChI (mnx)InChI=1/C30H50O2/c1-20(2)9-8-10-21(3)22-14-18-30(19-31)24-11-12-25-27(4,5)26(32)15-16-28(25,6)23(24)13-17-29(22,30)7/h9,21-22,25-26,31-32H,8,10-19H2,1-7H3/t21-,22-,25+,26+,28-,29-,30-/m1/s1 Image of MNXM6860
SMILES (mnx)[CH3:1][C:20]([CH3:2])=[CH:9][CH2:8][CH2:10][C@@H:21]([CH3:3])[C@H:22]1[CH2:14][CH2:18][C@@:30]2([CH2:19][OH:31])[C:24]3=[C:23]([CH2:13][CH2:17][C@:29]12[CH3:7])[C@@:28]1([CH3:6])[CH2:16][CH2:15][C@H:26]([OH:32])[C:27]([CH3:4])([CH3:5])[C@@H:25]1[CH2:12][CH2:11]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:166806
chebi:166806
DWVYYKFZEDMMPU-PUXRVUTHSA-N 		32-hydroxylanosterol
(3S,5R,10S,13R,14S,17R)-14-(hydroxymethyl)-4,4,10,13-tetramethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
32-Hydroxylanosterol
hmdb:HMDB0304022
DWVYYKFZEDMMPU-UHFFFAOYSA-N 		14-hydroxylanosterol
11-(hydroxymethyl)-2,6,6,15-tetramethyl-14-(6-methylhept-5-en-2-yl)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
4,4-Dimethyl-14a-hydroxymethyl-5a-cholesta-8,24-dien-3b-ol
4,4-Dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-ol

metacyc.compound:CPD-4568
metacycM:CPD-4568
DWVYYKFZEDMMPU-PUXRVUTHSA-N 		30-hydroxylanosterol
4,4-dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-ol

lipidmaps:LMST01010124
lipidmapsM:LMST01010124
DWVYYKFZEDMMPU-PUXRVUTHSA-N 		32-hydroxylanosterol
4,4-dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-ol
O2
ST 30:2
lanosta-8,24-dien-3beta,30-diol

bigg.metabolite:M00939
biggM:M00939
vmhM:M00939
vmhmetabolite:M00939
DWVYYKFZEDMMPU-PDJLJBAHSA-N
DWVYYKFZEDMMPU-UHFFFAOYSA-N 		4,4-Dimethyl-14Alpha-Hydroxymethyl-5Alpha-Cholesta-8,24-Dien-3Beta-Ol

seed.compound:cpd24498
seedM:cpd24498
DWVYYKFZEDMMPU-PUXRVUTHSA-N 		4,4-dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-ol
30-hydroxylanosterol

biggM:M_M00939
seedM:M_cpd24498
vmhM:M_M00939 		secondary/obsolete/fantasy identifier