1''-hydroxycannabidiol

Properties Image MNX_ID MNXM174274 reference chebi:133056 formula C21H30O3 global charge 0 mol weight 330.468 InChIKey OEWBQBNIVUMUKU-MYFVLZFPSA-N InChI InChI=1S/C21H30O3/c1-5-6-7-18(22)15-11-19(23)21(20(24)12-15)17-10-14(4)8-9-16(17)13(2)3/h10-12,16-18,22-24H,2,5-9H2,1,3-4H3/t16-,17+,18?/m0/s1 SMILES C=C(C)[C@@H]1CCC(C)=C[C@H]1C1=C(O)C=C(C(O)CCCC)C=C1O MNX internals InChI (mnx) InChI=1/C21H30O3/c1-5-6-7-18(22)15-11-19(23)21(20(24)12-15)17-10-14(4)8-9-16(17)13(2)3/h10-12,16-18,22-24H,2,5-9H2,1,3-4H3/t16-,17+,18?/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:6][CH2:7][CH:18]([C:15]1=[CH:11][C:19]([OH:23])=[C:21]([C@@H:17]2[CH:10]=[C:14]([CH3:4])[CH2:8][CH2:9][C@H:16]2[C:13](=[CH2:2])[CH3:3])[C:20]([OH:24])=[CH:12]1)[OH:22]

Parent-child relations graph

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