coumarin

Chemical Formula:

C₉H₆O₂

Molecular Weight:

146.145 Daltons

Monoisotopic Mass:

146.0367794368 Daltons

SMILES:

C1(OC2(=CC=CC=C(C=C1)2))=O

InChI:

1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H

InChIKey:

ZYGHJZDHTFUPRJ-UHFFFAOYSA-N

Synonyms

cumarin
1,2-benzopyrone

Databases

MetaCyc: COUMARIN

RefMet: Coumarin

MetaboLights: MTBLC28794

HMDB: HMDB01218

DRUGBANK: DB04665

ChemSpider: 13848793

PubChem (CID): 323

ChEBI: 28794

KEGG: C05851

Reactome: 76328

Seed: cpd03479

MetaNetX: MNXM2111