23S-methyl-5alpha-ergostan-3beta-ol

Properties Image MNX_ID MNXM25369 reference lipidmapsM:LMST01031074 formula C29H52O global charge 0 mol weight 416.734 InChIKey KTGGCSVZUGUIFS-GNFRWFFXSA-N InChI InChI=1S/C29H52O/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(30)12-14-28(22,6)27(24)13-15-29(25,26)7/h18-27,30H,8-17H2,1-7H3/t19-,20+,21+,22-,23-,24-,25+,26-,27-,28-,29+/m0/s1 SMILES CC(C)[C@@H](C)[C@@H](C)C[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 MNX internals InChI (mnx) InChI=1/C29H52O/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(30)12-14-28(22,6)27(24)13-15-29(25,26)7/h18-27,30H,8-17H2,1-7H3/t19-,20+,21+,22-,23-,24-,25+,26-,27-,28-,29+/m0/s1 SMILES (mnx) [CH3:1][CH:18]([CH3:2])[C@@H:21]([CH3:5])[C@@H:19]([CH3:3])[CH2:16][C@@H:20]([CH3:4])[C@H:25]1[CH2:10][CH2:11][C@H:26]2[C@@H:24]3[CH2:9][CH2:8][C@H:22]4[CH2:17][C@@H:23]([OH:30])[CH2:12][CH2:14][C@:28]4([CH3:6])[C@H:27]3[CH2:13][CH2:15][C@:29]12[CH3:7]

Parent-child relations graph

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