Compound Identification
SMILES
CCOC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)CN(CC(C)C)S(=O)(=O)C1=CC2=C(OCC2)C=C1)C(C)(C)C
InChIKey
InChIKey=CNIXJCHEFJPVTQ-PVTPYKNESA-N
Formula
C33H48N4O8S
Mass
660.83
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
-
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
Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Coumarans Alkyl aryl ethers Organosulfonamides N-acyl amines Aminosulfonyl compounds Carbamate esters Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Coumaran - Alkyl aryl ether - Fatty acyl - Monocyclic benzene moiety - N-acyl-amine - Fatty amide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Sulfonyl - Carbamic acid ester - Aminosulfonyl compound - Organosulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Ether - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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