Compound Identification
SMILES
O\N=C(/C(O)=O)C1=CSC(NC2C3SCC4=C(N3C2=O)C(=O)OC4O)=N1
InChIKey
InChIKey=KLFCUKDPLUCULK-BNCCVWRVSA-N
Formula
C13H10N4O7S2
Mass
398.36
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
Alpha amino acids and derivatives Cephems 2,4-disubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Butenolides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Ketoximes Heteroaromatic compounds Enoate esters Azetidines Lactones Hemiacetals Carboxylic acids Oxacyclic compounds Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Carbonyl compounds Amines Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Alpha-amino acid or derivatives - Cephem - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Dicarboxylic acid or derivatives - 1,3-thiazol-2-amine - 2-furanone - Dihydrofuran - Ketoxime - Tertiary carboxylic acid amide - Thiazole - Azole - Heteroaromatic compound - Beta-lactam - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Lactam - Lactone - Hemiacetal - Carboxylic acid ester - Carboxamide group - Azetidine - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid - Hemithioaminal - Thioether - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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