CHEBI:194149 - aristolochic acid B

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ChEBI Name aristolochic acid B
ChEBI ID CHEBI:194149
Definition An aristolochic acid that is phenanthrene-1-carboxylic acid substituted by a methylenedioxy group at the 3,4 positions and by a nitro group at position 10.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H9NO6
Net Charge 0
Average Mass 311.249
Monoisotopic Mass 311.04299
InChI InChI=1S/C16H9NO6/c18-16(19)10-6-12-15(23-7-22-12)14-9-4-2-1-3-8(9)5-11(13(10)14)17(20)21/h1-6H,7H2,(H,18,19)
InChIKey MEEXETVZNQYRSP-UHFFFAOYSA-N
SMILES OC(=O)C1=CC2=C(OCO2)C2=C1C(=CC1=C2C=CC=C1)[N+]([O-])=O
Metabolite of Species Details
Aristolochia (NCBI:txid12947) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
(via aristolochic acids )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
mutagen
An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
nephrotoxin
A poison that interferes with the function of the kidneys.
(via aristolochic acids )
toxin
Poisonous substance produced by a biological organism such as a microbe, animal or plant.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing aristolochic acid B (CHEBI:194149) has role carcinogenic agent (CHEBI:50903)
aristolochic acid B (CHEBI:194149) has role metabolite (CHEBI:25212)
aristolochic acid B (CHEBI:194149) has role mutagen (CHEBI:25435)
aristolochic acid B (CHEBI:194149) has role nephrotoxin (CHEBI:61015)
aristolochic acid B (CHEBI:194149) has role toxin (CHEBI:27026)
aristolochic acid B (CHEBI:194149) is a C-nitro compound (CHEBI:35716)
aristolochic acid B (CHEBI:194149) is a aristolochic acids (CHEBI:194147)
aristolochic acid B (CHEBI:194149) is a aromatic ether (CHEBI:35618)
aristolochic acid B (CHEBI:194149) is a cyclic acetal (CHEBI:59770)
aristolochic acid B (CHEBI:194149) is a monocarboxylic acid (CHEBI:25384)
aristolochic acid B (CHEBI:194149) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name
6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
Synonyms Sources
6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid IUPAC
AAB ChEBI
Citation Waiting for Citations Type Source
36347294 PubMed citation Europe PMC
Last Modified
05 December 2022