6,7-Dimethoxy-7-epirosmanol

Properties Image MNX_ID MNXM118350 reference chebi:172624 formula C22H30O6 global charge 0 mol weight 390.476 InChIKey MCHRWEBHSKWYBW-UHFFFAOYSA-N InChI InChI=1S/C22H30O6/c1-11(2)12-10-13-14(16(24)15(12)23)21-9-7-8-20(3,4)18(21)22(27-6,17(13)26-5)28-19(21)25/h10-11,17-18,23-24H,7-9H2,1-6H3 SMILES COC1C2=C(C(O)=C(O)C(C(C)C)=C2)C23CCCC(C)(C)C2C1(OC)OC3=O MNX internals InChI (mnx) InChI=1/C22H30O6/c1-11(2)12-10-13-14(16(24)15(12)23)21-9-7-8-20(3,4)18(21)22(27-6,17(13)26-5)28-19(21)25/h10-11,17-18,23-24H,7-9H2,1-6H3/t17?,18?,21?,22? SMILES (mnx) [CH3:1][CH:11]([CH3:2])[C:12]1=[CH:10][C:13]2=[C:14]([C:16]([OH:24])=[C:15]1[OH:23])[C:21]13[CH2:9][CH2:7][CH2:8][C:20]([CH3:3])([CH3:4])[CH:18]1[C:22]([O:27][CH3:6])([CH:17]2[O:26][CH3:5])[O:28][C:19]3=[O:25]

Parent-child relations graph

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