melilotate

Chemical Formula:

C₉H₉O₃

Molecular Weight:

165.168 Daltons

Monoisotopic Mass:

166.0629941873 Daltons

SMILES:

C(CCC1(C(=CC=CC=1)O))([O-])=O

InChI:

1S/C9H10O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-4,10H,5-6H2,(H,11,12)/p-1

InChIKey:

CJBDUOMQLFKVQC-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: MELILOTATE

RefMet: 3-(2-Hydroxyphenyl)propanoic acid

HMDB: HMDB33752

UMBBD-Compounds: c0398

ChemSpider: 5304883

PubChem (CID): 6930705 873

ChEBI: 46957

KEGG: C01198

CAS: 495-78-3

Seed: cpd00882

MetaNetX: MNXM1133