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4,4-dimethyl-5alpha-cholest-8-en-3beta-ol

PropertiesImage
MNX_IDMNXM5534 Image of MNXM5534
referencechebi:87044
formulaC29H50O
global charge0
mol weight414.718
InChIKeyFYHRVINOXYETMN-QGBOJXOESA-N
InChIInChI=1S/C29H50O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-20,22-23,25-26,30H,8-18H2,1-7H3/t20-,22-,23+,25+,26+,28-,29-/m1/s1
SMILESCC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
MNX internals
InChI (mnx)InChI=1/C29H50O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-20,22-23,25-26,30H,8-18H2,1-7H3/t20-,22-,23+,25+,26+,28-,29-/m1/s1 Image of MNXM5534
SMILES (mnx)[CH3:1][CH:19]([CH3:2])[CH2:9][CH2:8][CH2:10][C@@H:20]([CH3:3])[C@H:22]1[CH2:12][CH2:13][C@H:23]2[C:21]3=[C:24]([CH2:15][CH2:17][C@:28]12[CH3:6])[C@@:29]1([CH3:7])[CH2:18][CH2:16][C@H:26]([OH:30])[C:27]([CH3:4])([CH3:5])[C@@H:25]1[CH2:14][CH2:11]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)21
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:87044
chebi:87044
FYHRVINOXYETMN-QGBOJXOESA-N 		4,4-dimethyl-5alpha-cholest-8-en-3beta-ol
(3beta,5alpha)-4,4-dimethylcholest-8-en-3-ol
3beta-hydroxy-4,4-dimethyl-8(9)-cholestene
3beta-hydroxy-4,4-dimethylcholest-8(9)-ene
4,4-dimethyl-3beta-hydroxy-8(9)-cholestene
4,4-dimethyl-3beta-hydroxycholest-8(9)-ene
4,4-dimethyl-5alpha-cholesta-8-en-3beta-ol
4,4-dimethyl-8-cholesten-3beta-ol
4,4-dimethylcholest-8(9)-en-3beta-ol
4,4-dimethylcholesta-8(9)-en-3beta-ol

CHEBI:212200
chebi:212200
FYHRVINOXYETMN-HFPXORMNSA-N 		(3beta,4alpha,5alpha)-4,4-Dimethylcholest-8-en-3-OL
(3S,5R,10S,13R,17R)-4,4,10,13-tetramethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
hmdb:HMDB0006840
FYHRVINOXYETMN-HFPXORMNSA-N 		4,4-Dimethyl-5a-cholesta-8-en-3b-ol
(2S,5S,7R,14R,15R)-2,6,6,15-tetramethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
3beta-Hydroxy-4,4-dimethyl-8(9)-cholestene
3beta-Hydroxy-4,4-dimethylcholest-8(9)-ene
4,4-Dimethyl-3beta-hydroxy-8(9)-cholestene
4,4-Dimethyl-3beta-hydroxycholest-8(9)-ene
4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol
4,4-Dimethylcholest-8(9)-en-3beta-ol
4,4-Dimethylcholesta-8(9)-en-3beta-ol
THF-L-Glutamic acid
THF-Polyglutamate
Tetrahydrofolyl-[glu](n+1)
Tetrahydropteroyl-[gamma-glu]N
Tetrahydropteroyl-[gamma-glu]n+1

kegg.compound:C15915
keggC:C15915
FYHRVINOXYETMN-HFPXORMNSA-N 		4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol

seed.compound:cpd14644
seedM:cpd14644
FYHRVINOXYETMN-QGBOJXOESA-N 		4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol
4,4-dimethyl-5alpha-cholesta-8-en-3-beta-ol

lipidmaps:LMST01010225
lipidmapsM:LMST01010225
FYHRVINOXYETMN-QGBOJXOESA-N 		4,4-Dimethylcholest-8-enol
4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol
O
ST 29:1

SLM:000485366
slm:000485366
FYHRVINOXYETMN-QGBOJXOESA-N 		4,4-dimethyl-5alpha-cholest-8-en-3beta-ol

metacyc.compound:CPD-8610
metacycM:CPD-8610
FYHRVINOXYETMN-QGBOJXOESA-N 		4,4-dimethyl-5alpha-cholesta-8-en-3beta-ol
4,4-dimethylcholesta-8-en-3-ol

bigg.metabolite:CE2314
biggM:CE2314
FYHRVINOXYETMN-HFPXORMNSA-N 		4,4-dimethylcholesta-8(9)-en-3beta-ol

vmhM:CE2314
vmhmetabolite:CE2314
FYHRVINOXYETMN-HFPXORMNSA-N 		4,4-dimethylcholesta-8(9)-en-3beta-ol
(2S,5S,7R,14R,15R)-2,6,6,15-tetramethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol

hmdb:HMDB06840
chebi:80173
biggM:M_CE2314
keggC:M_C15915
seedM:M_cpd14644
vmhM:M_CE2314 		secondary/obsolete/fantasy identifier