Compound Identification
SMILES
COC1=CC=C(CN[C@H]([C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)OCC2=CC=CC=C2)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCCN2C=CN=C2)C=C1
InChIKey
InChIKey=MYGBLMSHDDZFGU-LOFFRUMASA-N
Formula
C42H55N7O7
Mass
769.944
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
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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 Benzyloxycarbonyls Anisoles Benzylamines Phenylmethylamines Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines N-acyl amines N-substituted imidazoles Heteroaromatic compounds Carbamate esters Secondary alcohols Secondary carboxylic acid amides Organic carbonic acids and derivatives Dialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzyloxycarbonyl - Phenylmethylamine - Phenol ether - Benzylamine - Methoxybenzene - Anisole - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Fatty amide - N-acyl-amine - N-substituted imidazole - Benzenoid - Carbamic acid ester - Imidazole - Heteroaromatic compound - Azole - Secondary alcohol - Carbonic acid derivative - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Organoheterocyclic compound - Ether - Azacycle - Secondary aliphatic amine - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Amine - 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