InCHi String:
InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
canonical SMILES: C1=CC(=C(C=C1C(CN)O)O)O
isomeric SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O
PUBCHEM iupac NAME: PUBCHEM iupac CAS NAME4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol
PUBCHEM iupac TRADITIONAL NAME4-[(1R)-2-amino-1-hydroxy-ethyl]pyrocatechol
PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac SYSTEMATIC NAME4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol
PubChem Substance (SID):
85165196 36883508 46506201PubChem Compound (CID):
439260KEGG: Compound ID
D00076CAS Registry IDs: 51-41-2
PDB Chemical Component
LNR LT4Miscellaneous Databases and IDs:
Sigma-Aldrich A7257_SIGMA
ChEBI CHEBI:18357 ChemBank Spectrum_001009
ChemSpider 388394
BIND 1830
EPA DSSTox 3378
NINDS Approved Drug Screening Program 01500436
DrugBank DB00368
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.