Compound Identification
SMILES
CCNC1=NC(NN2C(=O)\C(=C\C3=CC=CC=C3[N+]([O-])=O)N=C2C2=CC=CC=C2)=NC(NCC)=N1
InChIKey
InChIKey=ZHPKONCNVZCEIN-VKAVYKQESA-N
Formula
C23H23N9O3
Mass
473.497
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Nitrobenzenes 1,3,5-triazine-2,4-diamines Nitroaromatic compounds N-aliphatic s-triazines 1,3,5-triazines Imidazolinones Heteroaromatic compounds Amidrazones Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Organic zwitterions Amines Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Nitrobenzene - 2,4-diamine-s-triazine - Nitroaromatic compound - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Monocyclic benzene moiety - Imidazolinone - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - 2-imidazoline - Organic nitro compound - Carboxylic acid hydrazide - Carboxylic acid amidrazone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic salt - Amine - Organic oxide - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available