protocatechuate

Chemical Formula:

C₇H₅O₄

Molecular Weight:

153.114 Daltons

Monoisotopic Mass:

154.026608681 Daltons

SMILES:

C(C1(C=C(C(=CC=1)O)O))(=O)[O-]

InChI:

1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)/p-1

InChIKey:

YQUVCSBJEUQKSH-UHFFFAOYSA-M

Synonyms

4-carboxy-1,2-dihydroxybenzene
catechol-4-carboxylic acid
4,5-dihydroxybenzoic acid
benzoic acid, 3,4-dihydroxy-
3,4-DHBA
protocatehuic acid
3,4-dihydroxybenzoic acid
protocatechuic acid
3,4-dihydroxybenzoate
3,4-dihydrobenzoic acid
Pca

Databases

MetaCyc: 3-4-DIHYDROXYBENZOATE

RefMet: Protocatechuic acid

HMDB: HMDB01856

DRUGBANK: DB03946

ChemSpider: 3353991

PubChem (CID): 54675866 72

ChEBI: 36241 36062

KNApSAcK: C00002668

KEGG: C00230

CAS: 99-50-3

PupChem (SID): 3529

CHEMBL: CHEMBL37537

PDB-CCD: DHB

3DMET: B00064

NIKKAJI: J11.618A

MediaDB: compounds/225/

Reactome: 175977

Seed: cpd00197

MetaNetX: MNXM204