5alpha-cholesta-7,24-dien-3-one

Properties Image MNX_ID MNXM14956 reference metacycM:CPD-12929 formula C27H42O global charge 0 mol weight 382.632 InChIKey LHHHZZHKUVLCJI-IINKENNYSA-N InChI InChI=1S/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,10,19-20,23-25H,6,8-9,11-17H2,1-5H3/t19-,20+,23-,24+,25+,26+,27-/m1/s1 SMILES CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C MNX internals InChI (mnx) InChI=1/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,10,19-20,23-25H,6,8-9,11-17H2,1-5H3/t19-,20+,23-,24+,25+,26+,27-/m1/s1 SMILES (mnx) [CH3:1][C:18]([CH3:2])=[CH:7][CH2:6][CH2:8][C@@H:19]([CH3:3])[C@H:23]1[CH2:11][CH2:12][C@H:24]2[C:22]3=[CH:10][CH2:9][C@H:20]4[CH2:17][C:21](=[O:28])[CH2:13][CH2:15][C@:26]4([CH3:4])[C@H:25]3[CH2:14][CH2:16][C@:27]12[CH3:5]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0