myricetin 3-O-gentiobioside
Chemical Formula:
C27H30O18
Molecular Weight:
642.523 Daltons
Monoisotopic Mass:
642.1432141608 Daltons
SMILES:
C1(C(O)=C(O)C(O)=CC=1C4(OC5(C=C(O)C=C(O)C(C(=O)C(OC2(C(C(C(O)C(O2)COC3(C(C(C(O)C(O3)CO)O)O))O)O))=4)=5)))
InChI:
1S/C27H30O18/c28-5-13-17(34)20(37)22(39)26(43-13)41-6-14-18(35)21(38)23(40)27(44-14)45-25-19(36)15-9(30)3-8(29)4-12(15)42-24(25)7-1-10(31)16(33)11(32)2-7/h1-4,13-14,17-18,20-23,26-35,37-40H,5-6H2/t13-,14-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-14844
PubChem (CID):
90658494
MetaNetX:
MNXM114709