Chemical Component Summary

Name3,4-DIHYDROXYBENZOIC ACID
Identifiers3,4-dihydroxybenzoic acid
FormulaC7 H6 O4
Molecular Weight154.12
TypeNON-POLYMER
Isomeric SMILESc1cc(c(cc1C(=O)O)O)O
InChIInChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)
InChIKeyYQUVCSBJEUQKSH-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count17
Chiral Atom Count0
Bond Count17
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB03946 
Name3,4-Dihydroxybenzoic Acid
Groups experimental
Synonyms3,4-Dihydroxybenzoic Acid
Categories
  • Acids, Carbocyclic
  • Anticarcinogenic Agents
  • Antineoplastic Agents
  • Benzene Derivatives
  • Benzoates
CAS number99-50-3

Related Resource References

Resource NameReference
Pharos CHEMBL37537
PubChem 72
ChEMBL CHEMBL37537
ChEBI CHEBI:36062
CCDC/CSD RUWHOH, HUSGUZ, WOCHON01, ZEBXUB, WADJUI, HUSHOU, DUQXUL, ZOTMAZ, UGOVET, EDUWUW, ZEBXOV, WOCHON02, BIJDON03, XOKTIC, DUNSAI, XOKTOI, DUNRIP, HOWLOX, QISYID, BIJDON05, XOKTUO, ZEXJOE, WOCHON, WAJWAH, BIJDON04, IXUCEM, AWITUY, EDUDOA
COD 2228469, 4516328, 1556762, 2231758