patuletin

Chemical Formula:

C₁₆H₁₁O₈

Molecular Weight:

331.258 Daltons

Monoisotopic Mass:

332.053217362 Daltons

SMILES:

COC3(C(O)=C2(C(=O)C(=C(C1(C=C(O)C(O)=CC=1))OC2=CC(O)=3)[O-]))

InChI:

1S/C16H12O8/c1-23-16-9(19)5-10-11(13(16)21)12(20)14(22)15(24-10)6-2-3-7(17)8(18)4-6/h2-5,17-19,21-22H,1H3/p-1

InChIKey:

JMIFIYIEXODVTO-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: CPD-14907

RefMet: Patuletin

PubChem (CID): 90658881 5281678

MetaboLights: MTBLC75164

HMDB: HMDB30802

LIPID MAPS: LMPK12112986

ChEBI: 75164

ChemSpider: 4444997

KEGG: C10118

Seed: cpd07007

MetaNetX: MNXM95527