Compound Identification
SMILES
COCCCN1N=C(C)C2=C1C=C(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NC1CCN(CC1)C(C=O)C(O[N+]([O-])=O)C1=CC=CC=C1C(O)=O)C(C)C)C=C2
InChIKey
InChIKey=MVAJIHSSBNWCRH-HCFJMFHOSA-N
Formula
C41H60N6O9
Mass
780.964
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
- 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
Delta amino acids and derivatives
Alternative Parents
Benzoic acids Indazoles Benzoyl derivatives Aralkylamines Piperidines N-acyl amines Pyrazoles Alkyl nitrates Heteroaromatic compounds Secondary alcohols Trialkylamines Secondary carboxylic acid amides Organic nitro compounds Organic nitric acids and derivatives Amino acids 1,2-aminoalcohols Azacyclic compounds Dialkyl ethers Carboxylic acids Organic zwitterions Aldehydes Monoalkylamines Hydrocarbon derivatives Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Delta amino acid or derivatives - Indazole - Benzoic acid or derivatives - Benzopyrazole - Benzoic acid - Benzoyl - Aralkylamine - Fatty amide - Monocyclic benzene moiety - N-acyl-amine - Piperidine - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Organic nitrate - Pyrazole - Alkyl nitrate - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Organic nitro compound - Carboxamide group - Organic nitric acid or derivatives - 1,2-aminoalcohol - Tertiary aliphatic amine - Amino acid - Dialkyl ether - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aldehyde - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available