delphinidin 3,5-di-O-β-D-glucoside
Chemical Formula:
C27H30O17
Molecular Weight:
626.524 Daltons
Monoisotopic Mass:
627.1561245708 Daltons
SMILES:
C(O)C1(C(O)C(O)C(O)C(O1)OC5(C4(C=C(OC2(C(O)C(O)C(O)C(CO)O2))C(C3(C=C(O)C(O)=C(O)C=3))=[O+]C=4C=C([O-])C=5)))
InChI:
1S/C27H30O17/c28-6-16-19(34)21(36)23(38)26(43-16)41-14-4-9(30)3-13-10(14)5-15(25(40-13)8-1-11(31)18(33)12(32)2-8)42-27-24(39)22(37)20(35)17(7-29)44-27/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:
Synonyms
- delphinidin-3,5-diglucoside
Databases
MetaCyc:
CPD-7139
PubChem (CID):
25201902
HMDB:
HMDB30693
ChEBI:
77838
KEGG:
C16312
Seed:
cpd15028
MetaNetX:
MNXM146142