pelargonidin-3,5-di-O-β-D-glucoside
Chemical Formula:
C27H30O15
Molecular Weight:
594.525 Daltons
Monoisotopic Mass:
595.1662953266 Daltons
SMILES:
C(O)C5(C(C(C(C(OC3(=CC([O-])=CC2([O+]=C(C1(=CC=C(O)C=C1))C(=CC=23)OC4(C(O)C(O)C(O)C(CO)O4))))O5)O)O)O)
InChI:
1S/C27H30O15/c28-8-17-19(32)21(34)23(36)26(41-17)39-15-6-12(31)5-14-13(15)7-16(25(38-14)10-1-3-11(30)4-2-10)40-27-24(37)22(35)20(33)18(9-29)42-27/h1-7,17-24,26-29,32-37H,8-9H2,(H-,30,31)/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-7137
ChEBI:
57503
PubChem (CID):
167643
HMDB:
HMDB33681
KEGG:
C08725
Seed:
cpd05630
MetaNetX:
MNXM91262