Compound Identification
SMILES
O=C(OC1=CN(C(=O)C2CSC(N2)C2=CN=CC=C2)C2=C1C=C(OCC1=CC=CC=C1)C=C2)C(=O)OC1=CN(C(=O)C2CSC(N2)C2=CN=CC=C2)C2=C1C=C(OCC1=CC=CC=C1)C=C2
InChIKey
InChIKey=DJEMWKVKACYKOZ-UHFFFAOYSA-N
Formula
C50H40N6O8S2
Mass
917.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Indoles Phenol ethers Alkyl aryl ethers Substituted pyrroles Pyridines and derivatives Benzene and substituted derivatives Dicarboxylic acids and derivatives Thiazolidines Heteroaromatic compounds Carboxylic acid esters Dialkylthioethers Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Indole - Indole or derivatives - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyridine - Substituted pyrrole - Benzenoid - Thiazolidine - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Ether - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available