Structure Information
Structure

Compound Identification

SMILES

CC[C@@]1(OC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=S)NC2=CC=C(O[C@H]3O[C@@H](C)[C@@H](O)[C@@H](OC)[C@@H]3O)C=C2)C(C)C)C(=O)COC2=C1C=C1N(CC3=CC4=CC=CC=C4N=C13)C2=O

InChIKey

InChIKey=BFPYKUKXBCUQNN-HFGQMJQNSA-N

Formula

C45H54N6O11S

Mass

887.02

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha peptide - Phenolic glycoside - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Valine or derivatives - Alpha-amino acid amide - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - Quinoline - N-phenylthiourea - Pyranopyridine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Alpha-acyloxy ketone - Pyridinone - Fatty acid ester - Fatty amide - N-acyl-amine - Pyridine - Benzenoid - Monosaccharide - Fatty acyl - Monocyclic benzene moiety - Oxane - Heteroaromatic compound - Carboxylic acid ester - Secondary alcohol - Secondary carboxylic acid amide - Thiourea - Cyclic ketone - Carboxamide group - Amino acid or derivatives - Ketone - Lactam - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Primary amine - Organic nitrogen compound - Carbonyl group - Aldehyde - Alcohol - Amine - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary aliphatic amine - 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

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