Cyanidin 3-O-arabinoside

Properties Image MNX_ID MNXM124026 reference chebi:176345 formula C20H19O10 global charge 1 mol weight 419.362 InChIKey SBBFXSBQYRSIPP-GNBUJSLZSA-O InChI InChI=1S/C20H18O10/c21-7-16-17(26)18(27)20(30-16)29-15-6-10-12(24)4-9(22)5-14(10)28-19(15)8-1-2-11(23)13(25)3-8/h1-6,16-18,20-21,26-27H,7H2,(H3-,22,23,24,25)/p+1/t16-,17-,18+,20-/m0/s1 SMILES OC[C@@H]1O[C@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C=C2)[C@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C20H18O10/c21-7-16-17(26)18(27)20(30-16)29-15-6-10-12(24)4-9(22)5-14(10)28-19(15)8-1-2-11(23)13(25)3-8/h1-6,16-18,20-21,26-27H,7H2,(H3-,22,23,24,25)/t16-,17-,18+,20-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][C:11]([OH:23])=[C:13]([O-:25])[CH:3]=[C:8]1[C:19]1=[O+:28][C:14]2=[CH:5][C:9]([OH:22])=[CH:4][C:12]([OH:24])=[C:10]2[CH:6]=[C:15]1[O:29][C@@H:20]1[C@H:18]([OH:27])[C@@H:17]([OH:26])[C@H:16]([CH2:7][OH:21])[O:30]1

Parent-child relations graph

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