taxa-4(20),11-dien-5alpha-ol

Properties Image MNX_ID MNXM1295 reference chebi:30038 formula C20H32O global charge 0 mol weight 288.475 InChIKey QHDGSWAXTYWVOP-ZNWBIBPKSA-N InChI InChI=1S/C20H32O/c1-13-6-7-15-12-17-14(2)18(21)9-11-20(17,5)10-8-16(13)19(15,3)4/h15,17-18,21H,2,6-12H2,1,3-5H3/t15-,17+,18-,20+/m0/s1 SMILES C=C1[C@H]2C[C@@H]3CCC(C)=C(CC[C@]2(C)CC[C@@H]1O)C3(C)C MNX internals InChI (mnx) InChI=1/C20H32O/c1-13-6-7-15-12-17-14(2)18(21)9-11-20(17,5)10-8-16(13)19(15,3)4/h15,17-18,21H,2,6-12H2,1,3-5H3/t15-,17+,18-,20+/m0/s1 SMILES (mnx) [CH3:1][C:13]1=[C:16]2[CH2:8][CH2:10][C@:20]3([CH3:5])[CH2:11][CH2:9][C@H:18]([OH:21])[C:14](=[CH2:2])[C@H:17]3[CH2:12][C@H:15]([CH2:7][CH2:6]1)[C:19]2([CH3:3])[CH3:4]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 12 in models (compartimentalized) 0