Compound Identification
SMILES
COC(=O)CCCCN[C@@H](CN1C(=O)N(CC2=C(C=CC=C2F)C(F)(F)F)C(C)=C(C1=O)C1=C(F)C(OC)=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=SCXWUNDNFJGTSQ-MHZLTWQESA-N
Formula
C34H34F5N3O5
Mass
659.654
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
Phenylpyrimidines Trifluoromethylbenzenes Phenoxy compounds Anisoles Methoxybenzenes Fatty acid methyl esters Pyrimidones Alkyl aryl ethers Fluorobenzenes Aralkylamines Aryl fluorides Hydropyrimidines Vinylogous amides Heteroaromatic compounds Methyl esters Ureas Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Delta amino acid or derivatives - 5-phenylpyrimidine - Trifluoromethylbenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Fatty acid ester - Aralkylamine - Pyrimidone - Fatty acid methyl ester - Hydropyrimidine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Pyrimidine - Benzenoid - Vinylogous amide - Methyl ester - Heteroaromatic compound - Lactam - Carboxylic acid ester - Urea - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Amine - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic 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