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3alpha-Hydroxy-5beta-cholest-24-en-26-oic acid

PropertiesImage
MNX_IDMNXM26308 Image of MNXM26308
referencechebi:186752
formulaC27H44O3
global charge0
mol weight416.646
InChIKeySNPWCSWYZDJTND-CXNKPBRXSA-N
InChIInChI=1S/C27H44O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h7,17,19-24,28H,5-6,8-16H2,1-4H3,(H,29,30)/b18-7+/t17-,19-,20-,21+,22-,23+,24+,26+,27-/m1/s1
SMILESC/C(=C\CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)O
MNX internals
InChI (mnx)InChI=1/C27H44O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h7,17,19-24,28H,5-6,8-16H2,1-4H3,(H,29,30)/b18-7+/t17-,19-,20-,21+,22-,23+,24+,26+,27-/m1/s1 Image of MNXM26308
SMILES (mnx)[CH3:1][C@H:17]([CH2:6][CH2:5]/[CH:7]=[C:18](\[CH3:2])[C:25](=[O:29])[OH:30])[C@H:22]1[CH2:10][CH2:11][C@H:23]2[C@@H:21]3[CH2:9][CH2:8][C@@H:19]4[CH2:16][C@H:20]([OH:28])[CH2:12][CH2:14][C@:26]4([CH3:3])[C@H:24]3[CH2:13][CH2:15][C@:27]12[CH3:4]
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:186752
chebi:186752
SNPWCSWYZDJTND-CXNKPBRXSA-N 		3alpha-Hydroxy-5beta-cholest-24-en-26-oic acid
(E,6R)-6-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

lipidmaps:LMST04030145
lipidmapsM:LMST04030145
SNPWCSWYZDJTND-CXNKPBRXSA-N 		3alpha-Hydroxy-5beta-cholest-24-en-26-oic acid
O3
ST 27:2