(+)-Serradiol

Properties Image MNX_ID MNXM30153 reference lipidmapsM:LMPR0104150006 formula C20H32O2 global charge 0 mol weight 304.474 InChIKey YLPLMBSVCFKOSP-ICHMTLFLSA-N InChI InChI=1S/C20H32O2/c1-17(2)7-4-8-18(3)15(17)6-10-19-9-5-14(11-16(18)19)20(22,12-19)13-21/h5,9,14-16,21-22H,4,6-8,10-13H2,1-3H3/t14-,15+,16-,18+,19+,20+/m0/s1 SMILES CC1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@H](C[C@H]12)[C@](O)(CO)C3 MNX internals InChI (mnx) InChI=1/C20H32O2/c1-17(2)7-4-8-18(3)15(17)6-10-19-9-5-14(11-16(18)19)20(22,12-19)13-21/h5,9,14-16,21-22H,4,6-8,10-13H2,1-3H3/t14-,15+,16-,18+,19+,20+/m0/s1 SMILES (mnx) [CH3:1][C:17]1([CH3:2])[CH2:7][CH2:4][CH2:8][C@:18]2([CH3:3])[C@@H:15]1[CH2:6][CH2:10][C@@:19]13[CH:9]=[CH:5][C@@H:14]([CH2:11][C@@H:16]21)[C@@:20]([CH2:13][OH:21])([OH:22])[CH2:12]3

Parent-child relations graph

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