Compound Identification
SMILES
CC(C)[C@H](N)C(=O)NC1CCC(CC1)N1C(=O)N(C2=CC=CC(=C2)C2=CC=C(CN3CCCN(C)CC3)C=C2)C2=NC=C(F)C=C2C1=O
InChIKey
InChIKey=SMXATSHULNGROD-NXFUPXHFSA-N
Formula
C37H46FN7O3
Mass
655.819
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 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 Biphenyls and derivatives Pyrido[2,3-d]pyrimidines Benzylamines Phenylmethylamines 1,4-diazepanes Aralkylamines Pyrimidones Aryl fluorides Pyridines and derivatives N-acyl amines Heteroaromatic compounds Vinylogous amides Lactams Ureas Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Biphenyl - Pyrido[2,3-d]pyrimidine - Pyridopyrimidine - Phenylmethylamine - Benzylamine - 1,4-diazepane - Pyrimidone - Diazepane - Aralkylamine - Aryl fluoride - Pyridine - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Pyrimidine - Aryl halide - Heteroaromatic compound - Vinylogous amide - Urea - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Lactam - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Primary aliphatic amine - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - 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