Compound Identification
SMILES
CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1[C@H]2CCCC[C@@H]2C[C@H]1C(O)=O.COC1=C(OC)C=C(CCN(C)CCCC(C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)C=C1
InChIKey
InChIKey=HWDPVPHFEFAMOS-QSYPGBKBSA-N
Formula
C51H72N4O9
Mass
885.156
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Peptides
- Level 6 Dipeptides
-
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
Alpha amino acid esters N-acyl-L-alpha-amino acids Alpha amino acid amides Phenylbutylamines Dimethoxybenzenes Phenethylamines Indoles and derivatives Phenylpropanes Phenoxy compounds Pyrrolidine carboxylic acids N-acylpyrrolidines Anisoles Alkyl aryl ethers Fatty acid esters Aralkylamines Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Trialkylamines Amino acids Carboxylic acid esters Nitriles Dialkylamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - N-acyl-alpha-amino acid - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - Phenylbutylamine - Alpha-amino acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Phenylpropane - Phenethylamine - Indole or derivatives - Anisole - Phenoxy compound - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Pyrrolidine - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Amino acid - Carboxamide group - Carboxylic acid ester - Secondary amine - Nitrile - Carbonitrile - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Ether - Azacycle - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Cyanide - Amine - Organonitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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