delphinidin 3,7-di O-β-D-glucoside
Chemical Formula:
C27H30O17
Molecular Weight:
626.524 Daltons
Monoisotopic Mass:
627.1561245708 Daltons
SMILES:
C(O)C1(C(C(O)C(O)C(O1)OC2(C=C([O-])C5(=C(C=2)[O+]=C(C3(C=C(C(O)=C(O)C=3)O))C(OC4(C(O)C(C(O)C(CO)O4)O))=C5)))O)
InChI:
1S/C27H30O17/c28-6-16-19(34)21(36)23(38)26(43-16)40-9-3-11(30)10-5-15(42-27-24(39)22(37)20(35)17(7-29)44-27)25(41-14(10)4-9)8-1-12(31)18(33)13(32)2-8/h1-5,16-17,19-24,26-29,34-39H,6-7H2,(H3-,30,31,32,33)/t16-,17-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-15290
PubChem (CID):
90657962
MetaNetX:
MNXM23359
KEGG:
C20496