(4-Carboxy-4-hydroxycyclohexa-1,5-dien-1-yl)imino-methyl-oxidoazanium

AlkaPlorer ID: AK579342

Synonym: None

IUPAC Name: (4-carboxy-4-hydroxycyclohexa-1,5-dien-1-yl)imino-methyl-oxidoazanium

Structure

SMILES: C[N+]([O-])=NC1=CCC(O)(C(=O)O)C=C1

copy

InChI: InChI=1S/C8H10N2O4/c1-10(14)9-6-2-4-8(13,5-3-6)7(11)12/h2-4,13H,5H2,1H3,(H,11,12)

copy

InChIKey: YFGIIIHIVNEFGG-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 198.178

TPSA: 95.96

MolLogP: 0.2381999999999999

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information