Compound Identification
SMILES
COC1=C2C=C(C=C1)C1=NN(N=C1C1=CC=CC=C1)[C@@H]1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)CCCC\C=C/2)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1
InChIKey
InChIKey=QUTLPDZGPSKIKH-FTNHGIRISA-N
Formula
C45H57N7O8S
Mass
856.05
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 Cyclic peptides
-
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
Cyclic peptides
Alternative Parents
N-acyl-alpha amino acids and derivatives Macrolactams Alpha amino acid amides Phenyl-1,2,3-triazoles Pyrrolidinecarboxamides Anisoles Alkyl aryl ethers Benzene and substituted derivatives Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Organosulfonic acids and derivatives Aminosulfonyl compounds Carbamate esters Heteroaromatic compounds Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Organic oxides Organonitrogen compounds Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenyl-1,2,3-triazole - Phenyltriazole - Alpha-amino acid or derivatives - Anisole - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Alkyl aryl ether - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Triazole - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Aminosulfonyl compound - Carbamic acid ester - 1,2,3-triazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclic peptides. These are compounds containing a cyclic moiety bearing a peptide backbone.
External Descriptors
Not available