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5beta-Cholane-3alpha,7alpha,12alpha,24-tetrol

PropertiesImage
MNX_IDMNXM732912 Image of MNXM732912
referencechebi:168625
formulaC24H42O4
global charge0
mol weight394.596
InChIKeyBMSROUVLRAQRBY-YHEMGIGTSA-N
InChIInChI=1S/C24H42O4/c1-14(5-4-10-25)17-6-7-18-22-19(13-21(28)24(17,18)3)23(2)9-8-16(26)11-15(23)12-20(22)27/h14-22,25-28H,4-13H2,1-3H3/t14-,15+,16-,17-,18+,19+,20-,21+,22+,23+,24-/m1/s1
SMILESC[C@H](CCCO)[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]3C[C@H](O)[C@]12C
MNX internals
InChI (mnx)InChI=1/C24H42O4/c1-14(5-4-10-25)17-6-7-18-22-19(13-21(28)24(17,18)3)23(2)9-8-16(26)11-15(23)12-20(22)27/h14-22,25-28H,4-13H2,1-3H3/t14-,15+,16-,17-,18+,19+,20-,21+,22+,23+,24-/m1/s1 Image of MNXM732912
SMILES (mnx)[CH3:1][C@H:14]([CH2:5][CH2:4][CH2:10][OH:25])[C@H:17]1[CH2:6][CH2:7][C@H:18]2[C@H:22]3[C@H:19]([CH2:13][C@H:21]([OH:28])[C@:24]12[CH3:3])[C@@:23]1([CH3:2])[CH2:9][CH2:8][C@@H:16]([OH:26])[CH2:11][C@H:15]1[CH2:12][C@H:20]3[OH:27]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:168625
chebi:168625
BMSROUVLRAQRBY-YHEMGIGTSA-N 		5beta-Cholane-3alpha,7alpha,12alpha,24-tetrol
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol

lipidmaps:LMST04010302
lipidmapsM:LMST04010302
BMSROUVLRAQRBY-YHEMGIGTSA-N 		5beta-Cholane-3alpha,7alpha,12alpha,24-tetrol
O4
ST 24:0

sabiork.compound:27965
sabiorkM:27965
BMSROUVLRAQRBY-YHEMGIGTSA-N 		5beta-cholane-3alpha,7alpha,12alpha,24-tetrol