7beta-hydroxy-ent-sandaracopimaradiene

Properties Image MNX_ID MNXM147881 reference metacycM:CPD-16627 formula C20H32O global charge 0 mol weight 288.475 InChIKey BNRZBCUNLMPNJG-DSJDWBEOSA-N InChI InChI=1S/C20H32O/c1-6-19(4)11-8-15-14(13-19)16(21)12-17-18(2,3)9-7-10-20(15,17)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16+,17-,19-,20+/m1/s1 SMILES C=C[C@@]1(C)C=C2[C@@H](CC1)[C@]1(C)CCCC(C)(C)[C@H]1C[C@@H]2O MNX internals InChI (mnx) InChI=1/C20H32O/c1-6-19(4)11-8-15-14(13-19)16(21)12-17-18(2,3)9-7-10-20(15,17)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16+,17-,19-,20+/m1/s1 SMILES (mnx) [CH2:1]=[CH:6][C@:19]1([CH3:4])[CH2:11][CH2:8][C@@H:15]2[C:14](=[CH:13]1)[C@@H:16]([OH:21])[CH2:12][C@@H:17]1[C:18]([CH3:2])([CH3:3])[CH2:9][CH2:7][CH2:10][C@@:20]21[CH3:5]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0