sandaracopimaradiene-1alpha,9alpha-diol

Properties Image MNX_ID MNXM108690 reference chebi:69179 formula C20H32O2 global charge 0 mol weight 304.474 InChIKey NSRIQLOVXVWUAB-FLFBIERCSA-N InChI InChI=1S/C20H32O2/c1-6-18(4)11-12-20(22)14(13-18)7-8-15-17(2,3)10-9-16(21)19(15,20)5/h6,13,15-16,21-22H,1,7-12H2,2-5H3/t15-,16-,18-,19+,20+/m0/s1 SMILES C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@@]2(O)CC1 MNX internals InChI (mnx) InChI=1/C20H32O2/c1-6-18(4)11-12-20(22)14(13-18)7-8-15-17(2,3)10-9-16(21)19(15,20)5/h6,13,15-16,21-22H,1,7-12H2,2-5H3/t15-,16-,18-,19+,20+/m0/s1 SMILES (mnx) [CH2:1]=[CH:6][C@@:18]1([CH3:4])[CH2:11][CH2:12][C@@:20]2([OH:22])[C:14](=[CH:13]1)[CH2:7][CH2:8][C@H:15]1[C:17]([CH3:2])([CH3:3])[CH2:10][CH2:9][C@H:16]([OH:21])[C@@:19]12[CH3:5]

Parent-child relations graph

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