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aristolochic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM16153

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₇H₁₁NO₇

charge

mass

341.05355

reference

InChIKey

BBFQZRXNYIEMAW-UHFFFAOYSA-N

InChI

InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20)

SMILES

COc1cccc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-3296430 reactomeM:R-ALL-3296430 CHEBI:2825 chebi:2825	aristolochic acid 3,4-methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid 8-methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid 8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid Aristolochic acid Aristolochic acid I aristolochic acid A aristolochic acid-I aristolochin
seed.compound:cpd05378 seedM:cpd05378 kegg.compound:C08469 keggC:C08469	Aristolochic acid Aristolochic acid I
keggC:M_C08469 seedM:M_cpd05378	secondary/obsolete/fantasy identifier