Compound Identification
SMILES
O=C(NC(CC1=CC=CC=C1)C(=O)NC1=NN=C(S1)C1=CC2=C(OCO2)C=C1)NC12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=NPFPCMOWWHHESM-UHFFFAOYSA-N
Formula
C29H31N5O4S
Mass
545.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine 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
Phenylalanine and derivatives
Alternative Parents
N-carbamoyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Benzodioxoles N-arylamides Fatty amides Thiadiazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - N-carbamoyl-alpha-amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Benzodioxole - N-arylamide - Fatty amide - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Thiadiazole - Carboxamide group - Carbonic acid derivative - Urea - Secondary carboxylic acid amide - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available