Compound Identification
SMILES
NC1=NC(NCCC(O)=O)=NC(N\N=C\C2=CC=C(O2)[N+]([O-])=O)=N1
InChIKey
InChIKey=WQVOIDNJZCYHFY-LHHJGKSTSA-N
Formula
C11H12N8O5
Mass
336.268
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
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
Beta amino acids and derivatives
Alternative Parents
1,3,5-triazine-2,4-diamines Nitroaromatic compounds Nitrofurans N-aliphatic s-triazines 1,3,5-triazines Heteroaromatic compounds Amino acids Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Hydrazones Monocarboxylic acids and derivatives Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Primary amines Organic salts Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 2,4-diamine-s-triazine - Nitroaromatic compound - 2-nitrofuran - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - 1,3,5-triazine - Triazine - Furan - Heteroaromatic compound - Amino acid - C-nitro compound - Organic nitro compound - Carboxylic acid - Hydrazone - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available