23-demethyl-4alpha-methyl-5alpha-gorgostan-3beta-ol

Properties Image MNX_ID MNXM26044 reference chebi:173044 formula C30H52O global charge 0 mol weight 428.745 InChIKey VIFDEEMUSKCPJQ-WIQPDEQSSA-N InChI InChI=1S/C30H52O/c1-17(2)18(3)22-16-23(22)19(4)24-10-11-26-21-8-9-25-20(5)28(31)13-15-30(25,7)27(21)12-14-29(24,26)6/h17-28,31H,8-16H2,1-7H3/t18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28+,29-,30+/m1/s1 SMILES CC(C)[C@@H](C)[C@H]1C[C@@H]1[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@H](C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C MNX internals InChI (mnx) InChI=1/C30H52O/c1-17(2)18(3)22-16-23(22)19(4)24-10-11-26-21-8-9-25-20(5)28(31)13-15-30(25,7)27(21)12-14-29(24,26)6/h17-28,31H,8-16H2,1-7H3/t18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28+,29-,30+/m1/s1 SMILES (mnx) [CH3:1][CH:17]([CH3:2])[C@@H:18]([CH3:3])[C@H:22]1[CH2:16][C@@H:23]1[C@@H:19]([CH3:4])[C@H:24]1[CH2:10][CH2:11][C@H:26]2[C@@H:21]3[CH2:8][CH2:9][C@H:25]4[C@H:20]([CH3:5])[C@@H:28]([OH:31])[CH2:13][CH2:15][C@:30]4([CH3:7])[C@H:27]3[CH2:12][CH2:14][C@:29]12[CH3:6]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0