bmse000279 Urocanate at BMRB

InCHi String:
InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+

canonical SMILES:
C1=C(NC=N1)C=CC(=O)O

IUPAC: IUPAC openeye: IUPAC cas: IUPAC systematic
3-(3H-imidazol-4-yl)prop-2-enoic acid

IUPAC traditional
3-(3H-imidazol-4-yl)acrylic acid

PubChem Substance (SID):   111677738   150823   4043
PubChem Compound (CID):   1178
KEGG: Compound ID   C00785
CAS Registry IDs:   104-98-3
PDB Chemical Component   URO
Miscellaneous Databases and IDs:   ChemIDplus 000104983   EINECS 203-258-4   CCRIS 3414   Beilstein Handbook Reference 4-25-00-00786

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.