CHEBI:194152 - aristolochic acid D

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ChEBI Name aristolochic acid D
ChEBI ID CHEBI:194152
Definition An aristolochic acid that is phenanthrene-1-carboxylic acid substituted by a methylenedioxy group at the 3,4 positions, by an hydroxy group at position 6, by a methoxy group at position 8, 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 C17H11NO8
Net Charge 0
Average Mass 357.274
Monoisotopic Mass 357.04847
InChI InChI=1S/C17H11NO8/c1-24-12-3-7(19)2-9-8(12)4-11(18(22)23)14-10(17(20)21)5-13-16(15(9)14)26-6-25-13/h2-5,19H,6H2,1H3,(H,20,21)
InChIKey PADIFGYTAXNCRK-UHFFFAOYSA-N
SMILES COC1=CC(O)=CC2=C1C=C(C1=C2C2=C(OCO2)C=C1C(O)=O)[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.
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 D (CHEBI:194152) has role carcinogenic agent (CHEBI:50903)
aristolochic acid D (CHEBI:194152) has role metabolite (CHEBI:25212)
aristolochic acid D (CHEBI:194152) has role nephrotoxin (CHEBI:61015)
aristolochic acid D (CHEBI:194152) has role toxin (CHEBI:27026)
aristolochic acid D (CHEBI:194152) is a C-nitro compound (CHEBI:35716)
aristolochic acid D (CHEBI:194152) is a aristolochic acids (CHEBI:194147)
aristolochic acid D (CHEBI:194152) is a aromatic ether (CHEBI:35618)
aristolochic acid D (CHEBI:194152) is a cyclic acetal (CHEBI:59770)
aristolochic acid D (CHEBI:194152) is a monocarboxylic acid (CHEBI:25384)
aristolochic acid D (CHEBI:194152) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name
10-hydroxy-8-methoxy-6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
Synonyms Sources
10-hydroxy-8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid IUPAC
AAD ChEBI
Citation Waiting for Citations Type Source
36347294 PubMed citation Europe PMC
Last Modified
05 December 2022