Compound Identification
SMILES
COC1=CC(OC)=C(CN([C@@H](C)C(O)=O)C(=O)[C@H](CC(=O)OCC2=CC=C(NC(CC(C)C)=C3C(=O)CC(C)(C)CC3=O)C=C2)NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C23)C=C1
InChIKey
InChIKey=YYMPRGLLBXOFSL-SBIBQKHLSA-N
Formula
C51H57N3O11
Mass
888.027
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
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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
Aspartic acid and derivatives Fluorenes N-acyl-L-alpha-amino acids Alpha amino acid amides Alanine and derivatives Benzyloxycarbonyls Dimethoxybenzenes Phenoxy compounds Aniline and substituted anilines Anisoles Fatty acid esters Secondary alkylarylamines Alkyl aryl ethers Dicarboxylic acids and derivatives N-acyl amines Carbamate esters Vinylogous amides Tertiary carboxylic acid amides Cyclic ketones Carboxylic acid esters Amino acids Enamines Carboxylic acids Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Alpha-dipeptide - Aspartic acid or derivatives - Fluorene - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - Alanine or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Dimethoxybenzene - M-dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Fatty acid ester - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Dicarboxylic acid or derivatives - Fatty acyl - N-acyl-amine - Monocyclic benzene moiety - Carbamic acid ester - Tertiary carboxylic acid amide - Vinylogous amide - Amino acid - Ketone - Carboxamide group - Amino acid or derivatives - Carboxylic acid ester - Cyclic ketone - Secondary amine - Ether - Carboxylic acid - Enamine - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Aromatic homopolycyclic 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