Compound Identification
SMILES
COC1=CC=CC2=C3C(O)=C(O)C=C(C(O)=O)C3=C(C=C12)[N+]([O-])=O
InChIKey
InChIKey=UGDCYONWMSTCOX-UHFFFAOYSA-N
Formula
C16H11NO7
Mass
329.264
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenanthrenes and derivatives
- Subclass Aristolochic acids and derivatives
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Class
Phenanthrenes and derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Aristolochic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Aristolochic acids and derivatives
Alternative Parents
Phenanthrols Naphthalenecarboxylic acids Nitronaphthalenes Naphthols and derivatives Hydroxybenzoic acid derivatives Anisoles Nitroaromatic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Hydrocarbon derivatives Organonitrogen compounds Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Aristolochic acid or derivatives - Phenanthrol - 2-nitronaphthalene - 1-nitronaphthalene - 1-naphthalenecarboxylic acid or derivatives - 1-naphthalenecarboxylic acid - Dihydroxybenzoic acid - 1-naphthol - 2-naphthol - Naphthalene - Hydroxybenzoic acid - Phenol ether - Anisole - Nitroaromatic compound - Phenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as aristolochic acids and derivatives. These are organic heterocyclic compounds with a structure characterized by a nitrophenanthro[3,4-d][1,3]dioxole ring system substituted at position 5, 6, and 8 by a carboxyl group (or a derivative thereof), a nitro group, and a methoxy group, respectively.
External Descriptors
Not available