cyanidin 5-O-β-D-glucoside
Chemical Formula:
C21H19O11
Molecular Weight:
447.374 Daltons
Monoisotopic Mass:
449.10838651719996 Daltons
SMILES:
C(O)C1(C(O)C(O)C(O)C(O1)OC4(C3(C=C([O-])C(C2(=CC=C(O)C(O)=C2))=[O+]C=3C=C([O-])C=4)))
InChI:
1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-5-9(23)4-14-10(15)6-13(26)20(30-14)8-1-2-11(24)12(25)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p-1/t16-,17-,18+,19-,21-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-7386
PubChem (CID):
25203612
KEGG:
C16298
MetaNetX:
MNXM5694
ChEBI:
80434