Compound Identification
SMILES
COC1=CC=CC(CNC(C(O)C(CC2=CC=CC=C2)NC(=O)C(NC(=O)OCC2CCC3=CC=CC=C3C2)C(C)(C)C)C(=O)NC2C(O)CC3=CC=CC=C23)=C1
InChIKey
InChIKey=DDQUEUXWSZKDCM-UHFFFAOYSA-N
Formula
C46H56N4O7
Mass
776.975
Taxonomic Classification
Taxonomy Tree
-
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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 - Alpha amino acids and derivatives
Direct Parent
Valine and derivatives
Alternative Parents
Alpha amino acid amides Phenylbutylamines Tetralins Amphetamines and derivatives Indanes Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Phenylmethylamines Alkyl aryl ethers Aralkylamines N-acyl amines Carbamate esters Secondary alcohols Secondary carboxylic acid amides Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Tetralin - Indane - Phenoxy compound - Anisole - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Benzenoid - Monocyclic benzene moiety - N-acyl-amine - Fatty acyl - Fatty amide - Carbamic acid ester - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Secondary amine - Ether - Secondary aliphatic amine - Alcohol - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available