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5alpha-Cholestane-3alpha,7alpha,25-triol

PropertiesImage
MNX_IDMNXM28542 Image of MNXM28542
referencechebi:187336
formulaC27H48O3
global charge0
mol weight420.678
InChIKeyUROPIWALBBMYRP-CEIFOQQWSA-N
InChIInChI=1S/C27H48O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h17-24,28-30H,6-16H2,1-5H3/t17-,18-,19-,20-,21+,22+,23-,24+,26+,27-/m1/s1
SMILESC[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C27H48O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h17-24,28-30H,6-16H2,1-5H3/t17-,18-,19-,20-,21+,22+,23-,24+,26+,27-/m1/s1 Image of MNXM28542
SMILES (mnx)[CH3:1][C@H:17]([CH2:7][CH2:6][CH2:12][C:25]([CH3:2])([CH3:3])[OH:30])[C@H:20]1[CH2:8][CH2:9][C@H:21]2[C@H:24]3[C@H:22]([CH2:11][CH2:14][C@:27]12[CH3:5])[C@@:26]1([CH3:4])[CH2:13][CH2:10][C@@H:19]([OH:28])[CH2:15][C@@H:18]1[CH2:16][C@H:23]3[OH:29]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:187336
chebi:187336
UROPIWALBBMYRP-CEIFOQQWSA-N 		5alpha-Cholestane-3alpha,7alpha,25-triol
(3R,5R,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

lipidmaps:LMST04030090
lipidmapsM:LMST04030090
UROPIWALBBMYRP-CEIFOQQWSA-N 		5alpha-Cholestane-3alpha,7alpha,25-triol
O3
ST 27:0