Compound Identification
SMILES
COC1=CC(OC)=C(Cl)C=C1C1=NO[C@@]2(C[C@H](N(C2)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)C[C@@H](CC2CC2)C(=O)C(N)=O)C1
InChIKey
InChIKey=DNMICMHBYZLEJP-DXWNVVBRSA-N
Formula
C34H47ClN4O9
Mass
691.22
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
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 Dimethoxybenzenes Anisoles Phenoxy compounds N-acylpyrrolidines Alkyl aryl ethers Chlorobenzenes Aryl chlorides Fatty amides Tertiary carboxylic acid amides Carbamate esters Isoxazolines Tertiary amines Ketones Primary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Dimethoxybenzene - M-dimethoxybenzene - Phenoxy compound - Anisole - N-acylpyrrolidine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Fatty acyl - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Isoxazoline - Primary carboxylic acid amide - Ketone - Tertiary amine - Carboxamide group - Azacycle - Oxacycle - Organoheterocyclic compound - Ether - Organochloride - Organic nitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Organic oxide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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