11,12-Dimethylrosmanol

Properties Image MNX_ID MNXM116097 reference chebi:174966 formula C22H30O5 global charge 0 mol weight 374.477 InChIKey WLRZIPVGEMNPES-UHFFFAOYSA-N InChI InChI=1S/C22H30O5/c1-11(2)12-10-13-14(17(26-6)16(12)25-5)22-9-7-8-21(3,4)19(22)18(15(13)23)27-20(22)24/h10-11,15,18-19,23H,7-9H2,1-6H3 SMILES COC1=C(OC)C2=C(C=C1C(C)C)C(O)C1OC(=O)C23CCCC(C)(C)C13 MNX internals InChI (mnx) InChI=1/C22H30O5/c1-11(2)12-10-13-14(17(26-6)16(12)25-5)22-9-7-8-21(3,4)19(22)18(15(13)23)27-20(22)24/h10-11,15,18-19,23H,7-9H2,1-6H3/t15?,18?,19?,22? SMILES (mnx) [CH3:1][CH:11]([CH3:2])[C:12]1=[CH:10][C:13]2=[C:14]([C:17]([O:26][CH3:6])=[C:16]1[O:25][CH3:5])[C:22]13[CH2:9][CH2:7][CH2:8][C:21]([CH3:3])([CH3:4])[CH:19]1[CH:18]([CH:15]2[OH:23])[O:27][C:20]3=[O:24]

Parent-child relations graph

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