ochrocarpin C

Properties Image MNX_ID MNXM107354 reference chebi:66813 formula C24H22O6 global charge 0 mol weight 406.434 InChIKey VUTHGCZKFOZRRG-UHFFFAOYSA-N InChI InChI=1S/C24H22O6/c1-12(2)20(26)19-21(27)18-14(13-8-6-5-7-9-13)11-17(25)30-22(18)15-10-16(24(3,4)28)29-23(15)19/h5-12,27-28H,1-4H3 SMILES CC(C)C(=O)C1=C2OC(C(C)(C)O)=CC2=C2OC(=O)C=C(C3=CC=CC=C3)C2=C1O MNX internals InChI (mnx) InChI=1/C24H22O6/c1-12(2)20(26)19-21(27)18-14(13-8-6-5-7-9-13)11-17(25)30-22(18)15-10-16(24(3,4)28)29-23(15)19/h5-12,27-28H,1-4H3 SMILES (mnx) [CH3:1][CH:12]([CH3:2])[C:20]([C:19]1=[C:23]2[C:15](=[C:22]3[C:18](=[C:21]1[OH:27])[C:14]([C:13]1=[CH:8][CH:6]=[CH:5][CH:7]=[CH:9]1)=[CH:11][C:17](=[O:25])[O:30]3)[CH:10]=[C:16]([C:24]([CH3:3])([CH3:4])[OH:28])[O:29]2)=[O:26]

Parent-child relations graph

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