Compound Identification
SMILES
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1=CC=C(C=C1)C1=C(CC2=CC=C(OCCN3CCCC3)C=C2)C2=CC=CC=C2S1
InChIKey
InChIKey=COTPYUJLTCABNJ-HKBQPEDESA-N
Formula
C37H43N3O6S
Mass
657.83
Taxonomic Classification
Taxonomy Tree
-
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Aspartic acid 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
Aspartic acid and derivatives
Alternative Parents
Alpha amino acid amides Anilides 1-benzothiophenes N-arylamides Phenoxy compounds Phenol ethers Fatty acid methyl esters Alkyl aryl ethers Fatty amides N-alkylpyrrolidines Methyl esters Heteroaromatic compounds Thiophenes Carbamate esters Trialkylamines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspartic acid or derivatives - Alpha-amino acid amide - 1-benzothiophene - Benzothiophene - Anilide - Phenoxy compound - Phenol ether - N-arylamide - Alkyl aryl ether - Fatty acid ester - Fatty acid methyl ester - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - N-alkylpyrrolidine - Heteroaromatic compound - Pyrrolidine - Thiophene - Carbamic acid ester - Methyl ester - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Ether - Azacycle - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available