Compound Identification
SMILES
COC1=C(OC)C=C(C(COC(=O)N2CCCN2C(=O)CNC(=O)C2=CC=CO2)=C1)[N+]([O-])=O
InChIKey
InChIKey=JYWPJERWAYCWQP-UHFFFAOYSA-N
Formula
C20H22N4O9
Mass
462.415
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Nitrophenyl ethers Dimethoxybenzenes Benzyloxycarbonyls Methoxyanilines Furoic acid and derivatives Nitroaromatic compounds Phenoxy compounds Anisoles 2-heteroaryl carboxamides Alkyl aryl ethers Heteroaromatic compounds Pyrazolidines Carboxylic acid hydrazides Secondary carboxylic acid amides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Nitrophenyl ether - Dimethoxybenzene - O-dimethoxybenzene - Benzyloxycarbonyl - Nitrobenzene - Methoxyaniline - Phenol ether - Furoic acid or derivatives - 2-heteroaryl carboxamide - Phenoxy compound - Nitroaromatic compound - Methoxybenzene - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyrazolidine - Furan - Heteroaromatic compound - Secondary carboxylic acid amide - C-nitro compound - Organic nitro compound - Carboxylic acid hydrazide - Carboxamide group - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organopnictogen compound - Organic oxygen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available