Compound Identification
SMILES
COC1=C(C)C(C)=C(C(C)=C1)S(=O)(=O)\N=C(\N)CCCCC(NC(=O)[C@@H]1CCCN1C(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)OC(C)(C)C)C(=O)CCC(=O)N1CCCCC1
InChIKey
InChIKey=IRNUDCIADDKQFP-BUWWEWLSSA-N
Formula
C48H66N6O9S
Mass
903.15
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
Proline and derivatives Alpha amino acid amides Benzenesulfonamides Naphthalenes Benzenesulfonyl compounds N-acylpiperidines N-acylpyrrolidines Methoxybenzenes Anisoles Phenoxy compounds Pyrrolidinecarboxamides Alkyl aryl ethers Organosulfonic acids and derivatives Tertiary carboxylic acid amides Carbamate esters Sulfonyls Secondary carboxylic acid amides Ketones Azacyclic compounds Amidines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Naphthalene - Alpha-amino acid or derivatives - Benzenesulfonamide - N-acyl-piperidine - Benzenesulfonyl group - N-acylpyrrolidine - Phenoxy compound - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Anisole - Methoxybenzene - Alkyl aryl ether - Benzenoid - Piperidine - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Sulfonyl - Tertiary carboxylic acid amide - Carbamic acid ester - Secondary carboxylic acid amide - Carboxamide group - Ketone - Amidine - Azacycle - Organoheterocyclic compound - Ether - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen 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