isourolithin A 3-O-glucuronide

isourolithin A 3-<i>O</i>-glucuronide




Chemical Formula:
C19H15O10
Molecular Weight:
403.321 Daltons
Monoisotopic Mass:
404.0743467346 Daltons
SMILES:
C(=O)([O-])C1(C(O)C(O)C(O)C(O1)OC4(=CC=C3(C(OC(=O)C2(=C(C=C(O)C=C2)3))=C4)))
InChI:
1S/C19H16O10/c20-7-1-3-10-11(5-7)9-4-2-8(6-12(9)28-18(10)26)27-19-15(23)13(21)14(22)16(29-19)17(24)25/h1-6,13-16,19-23H,(H,24,25)/p-1/t13-,14-,15+,16-,19+/m0/s1
InChIKey:
AAJFARBDABAXSP-KSPMYQCISA-M

Databases
MetaCyc:  CPD-20721
PubChem (CID):  131841549