Search MNXref
 Feedback

5beta-Cholest-25-ene-3alpha,7alpha,12alpha,24-tetrol

PropertiesImage
MNX_IDMNXM23551 Image of MNXM23551
referencechebi:187738
formulaC27H46O4
global charge0
mol weight434.661
InChIKeyCSDWJHDWSDHYHH-HTIJMCESSA-N
InChIInChI=1S/C27H46O4/c1-15(2)22(29)9-6-16(3)19-7-8-20-25-21(14-24(31)27(19,20)5)26(4)11-10-18(28)12-17(26)13-23(25)30/h16-25,28-31H,1,6-14H2,2-5H3/t16-,17+,18-,19-,20+,21+,22?,23-,24+,25+,26+,27-/m1/s1
SMILESC=C(C)C(O)CC[C@@H](C)[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/C27H46O4/c1-15(2)22(29)9-6-16(3)19-7-8-20-25-21(14-24(31)27(19,20)5)26(4)11-10-18(28)12-17(26)13-23(25)30/h16-25,28-31H,1,6-14H2,2-5H3/t16-,17+,18-,19-,20+,21+,22?,23-,24+,25+,26+,27-/m1/s1 Image of MNXM23551
SMILES (mnx)[CH2:1]=[C:15]([CH3:2])[CH:22]([CH2:9][CH2:6][C@@H:16]([CH3:3])[C@H:19]1[CH2:7][CH2:8][C@H:20]2[C@H:25]3[C@H:21]([CH2:14][C@H:24]([OH:31])[C@:27]12[CH3:5])[C@@:26]1([CH3:4])[CH2:11][CH2:10][C@@H:18]([OH:28])[CH2:12][C@H:17]1[CH2:13][C@H:23]3[OH:30])[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:187738
chebi:187738
CSDWJHDWSDHYHH-HTIJMCESSA-N 		5beta-Cholest-25-ene-3alpha,7alpha,12alpha,24-tetrol
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-hydroxy-6-methylhept-6-en-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:LMST04030097
lipidmapsM:LMST04030097
CSDWJHDWSDHYHH-HTIJMCESSA-N 		5beta-Cholest-25-ene-3alpha,7alpha,12alpha,24-tetrol
O4
ST 27:1