Catechin-4-ol 3-O-beta-D-glycopyranoside

Properties Image MNX_ID MNXM27035 reference lipidmapsM:LMPK12020200 formula C21H24O12 global charge 0 mol weight 468.411 InChIKey XVCDTACMJMYHGB-OLIINTSTSA-N InChI InChI=1S/C21H24O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15-30H,6H2/t13-,15-,16?,17+,18-,19-,20+,21+/m1/s1 SMILES OC[C@H]1O[C@@H](O[C@H]2C(O)C3=C(C=C(O)C=C3O)O[C@@H]2C2=CC(O)=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C21H24O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15-30H,6H2/t13-,15-,16?,17+,18-,19-,20+,21+/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][C:9]([OH:24])=[C:10]([OH:25])[CH:3]=[C:7]1[C@@H:19]1[C@@H:20]([O:33][C@H:21]2[C@H:18]([OH:30])[C@@H:17]([OH:29])[C@H:15]([OH:27])[C@@H:13]([CH2:6][OH:22])[O:32]2)[CH:16]([OH:28])[C:14]2=[C:11]([OH:26])[CH:4]=[C:8]([OH:23])[CH:5]=[C:12]2[O:31]1

Parent-child relations graph

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