Compound Identification
SMILES
COC1=CC=C(CSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)NCCCNC2=CC=CC3=C2C(=O)C2=CC=CC=C2C3=O)C=C1
InChIKey
InChIKey=AUSXYDCOSNANBS-RIUGZMFHSA-N
Formula
C50H65N9O10S
Mass
984.18
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
-
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
Not available
Direct Parent
Peptides
Alternative Parents
Anthraquinones Leucine and derivatives Proline and derivatives N-acyl-alpha amino acids and derivatives Cysteine and derivatives Alpha amino acid amides Alanine and derivatives Aryl ketones Anisoles Pyrrolidinecarboxamides Phenoxy compounds N-acylpyrrolidines Methoxybenzenes Secondary alkylarylamines Alkyl aryl ethers Vinylogous amides Tertiary carboxylic acid amides Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Azacyclic compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - Anthraquinone - 9,10-anthraquinone - Anthracene - Leucine or derivatives - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Alpha-amino acid amide - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Anisole - Phenol ether - N-acylpyrrolidine - Pyrrolidine-2-carboxamide - Phenoxy compound - Aryl ketone - Methoxybenzene - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Tertiary carboxylic acid amide - Pyrrolidine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Secondary amine - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Ether - Thioether - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available