Compound Identification
SMILES
COC1=CC(\C=N\OC2CC(N(CCC(C)(C)C)C2)C(=O)N[C@]2(C[C@H]2C=C)C(=O)NS(=O)(=O)C2CC2)=C(C=C1)C1=CC=CS1
InChIKey
InChIKey=QVLVZKYNWOQSCU-ZNLCSPDXSA-N
Formula
C32H42N4O6S2
Mass
642.83
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
Peptides
- Level 6 Dipeptides
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Level 5
Peptides
-
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
Peptides
Direct Parent
Dipeptides
Alternative Parents
N-acyl-alpha amino acids and derivatives Proline and derivatives Alpha amino acid amides Anisoles Pyrrolidinecarboxamides Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Cyclopropanecarboxylic acids and derivatives N-alkylpyrrolidines Thiophenes Aminosulfonyl compounds Organosulfonic acids and derivatives Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Sulfonyl - Organosulfonic acid or derivatives - Thiophene - Heteroaromatic compound - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available