quercetin-3,4'-bissulfate
Chemical Formula:
C15H7O13S2
Molecular Weight:
459.332 Daltons
Monoisotopic Mass:
461.9562817883 Daltons
SMILES:
C1(C=C(OS(=O)(=O)[O-])C(O)=CC=1C2(OC3(C=C([O-])C=C(O)C(C(=O)C(OS(=O)(=O)[O-])=2)=3)))
InChI:
1S/C15H10O13S2/c16-7-4-9(18)12-11(5-7)26-14(15(13(12)19)28-30(23,24)25)6-1-2-10(8(17)3-6)27-29(20,21)22/h1-5,16-18H,(H,20,21,22)(H,23,24,25)/p-3
InChIKey:
Databases
MetaCyc:
QUERCETIN-34-BISSULFATE
ChEBI:
58353
PubChem (CID):
25202871
KEGG:
C01156
Seed:
cpd00850
MetaNetX:
MNXM3348