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
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Peptides
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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
Not available
Direct Parent
Peptides
Alternative Parents
Phenolic glycosides Valine and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Alpha amino acid amides Hexoses O-glycosyl compounds Quinolines and derivatives Pyranopyridines N-phenylthioureas Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyridinones Alpha-acyloxy ketones Fatty acid esters Oxanes N-acyl amines Heteroaromatic compounds Thioureas Secondary carboxylic acid amides Secondary alcohols Carboxylic acid esters Cyclic ketones Lactams Dialkyl ethers Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Aldehydes Organopnictogen compounds Hydrocarbon derivatives Monoalkylamines
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