Compound Identification
SMILES
CC(C)(C)OP(=O)(CC1=CC=C(C=C1)[C@@H](C=C)[C@H](N=[N+]=[N-])C(O)=O)OC(C)(C)C
InChIKey
InChIKey=NBRFGUUKFWJIDJ-SJORKVTESA-N
Formula
C20H30N3O5P
Mass
423.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Alpha amino acids and derivatives Aromatic monoterpenoids Monocyclic monoterpenoids Dialkyl alkylphosphonates Phosphonic acid esters Benzene and substituted derivatives Azo compounds Azo imides Monocarboxylic acids and derivatives Carboxylic acids Organophosphorus compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Alpha-amino acid or derivatives - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Dialkyl alkylphosphonate - Phosphonic acid diester - Benzenoid - Monocyclic benzene moiety - Phosphonic acid ester - Organophosphonic acid derivative - Azo compound - Azo imide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available