Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(CC1=C(Cl)C=[N+]([O-])C=C1Cl)OC(=O)COC(=O)C1=CC(NC(C(=O)O[C@H]2CN3CCC2CC3)C2=CC=CC=C2)=CC=C1
InChIKey
InChIKey=NQGOTPCUAXMDGY-OCSOCYDSSA-N
Formula
C39H39Cl2N3O9
Mass
764.65
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
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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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
-
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
Alpha amino acid esters
Alternative Parents
Aminobenzoic acids and derivatives Benzoic acid esters Benzyloxycarbonyls Dimethoxybenzenes Tricarboxylic acids and derivatives Quinuclidines Polyhalopyridines Aniline and substituted anilines Phenylalkylamines Phenoxy compounds Anisoles Benzoyl derivatives Alkyl aryl ethers Secondary alkylarylamines Pyridinium derivatives Piperidines Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Trialkylamines Azacyclic compounds Carbonyl compounds Organic oxides Organic salts Organochlorides Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Aminobenzoic acid or derivatives - Benzoate ester - Benzyloxycarbonyl - Dimethoxybenzene - O-dimethoxybenzene - Benzoic acid or derivatives - Tricarboxylic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Quinuclidine - Aniline or substituted anilines - Phenylalkylamine - Polyhalopyridine - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyridine - Pyridinium - Heteroaromatic compound - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Ether - Organoheterocyclic compound - Azacycle - Secondary amine - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available