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paerucumarin

Go to external page http://purl.obolibrary.org/obo/CHEBI_140649

A hydroxycoumarin that is coumarin substituted by an isocyano group at position 3 and hydroxy groups at positions 6 and 7.

Term info

Label

paerucumarin

Synonyms
  • 6,7-dihydroxy-3-isocyano-2H-chromen-2-one
database cross reference
Subsets

3_STAR

IUPAC NAME
6,7-dihydroxy-3-isocyano-2H-chromen-2-one [ IUPAC ]

charge

0

formula

C10H5NO4

has obo namespace

chebi_ontology

has related synonym

6,7-dihydroxy-3-isocyano-2H-1-benzopyran-2-one, 6,7-dihydroxy-3-isocyanochromen-2-one

id

CHEBI:140649

inchi

InChI=1S/C10H5NO4/c1-11-6-2-5-3-7(12)8(13)4-9(5)15-10(6)14/h2-4,12-13H

inchikey

PBXVYKHISUQHKY-UHFFFAOYSA-N

mass

203.153

monoisotopicmass

203.02186

smiles

O1C(=O)C([N+]#[C-])=CC2=C1C=C(C(=C2)O)O