Compound Identification
SMILES
CC[C@H]1NC(=O)[C@@H](NC(=O)C2=NC=CC=C2O)[C@@H](C)OC(=O)[C@@H](NC(=O)C2CC(=O)C(CS[C@@H]3CN4CCC3CC4)CN2C(=O)[C@H](CC2=CC=C(C=C2)N(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O)C1=CC=CC=C1
InChIKey
InChIKey=WTHRRGMBUAHGNI-MJWHERSYSA-N
Formula
C53H67N9O10S
Mass
1022.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
Class
Peptidomimetics
-
Subclass
Depsipeptides
- Level 5 Cyclic depsipeptides
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Subclass
Depsipeptides
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Class
Peptidomimetics
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Peptidomimetics
Subclass
Depsipeptides
Intermediate Tree Nodes
Not available
Direct Parent
Cyclic depsipeptides
Alternative Parents
Macrolide lactams Alpha amino acid esters Macrolactams N-acyl-alpha amino acids and derivatives Pyridinecarboxamides Quinuclidines 2-heteroaryl carboxamides Aniline and substituted anilines Dialkylarylamines Piperidinones Hydroxypyridines Pyrrolidines Vinylogous acids Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Carboxylic acid esters Cyclic ketones Lactams Lactones Trialkylamines Dialkylthioethers Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic depsipeptide - Macrolide lactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Macrolactam - Alpha-amino acid or derivatives - Pyridine carboxylic acid or derivatives - Pyridinecarboxamide - 2-heteroaryl carboxamide - Aniline or substituted anilines - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Piperidinone - Hydroxypyridine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyridine - Vinylogous acid - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Lactone - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Oxacycle - Thioether - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Amine - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclic depsipeptides. These are natural or synthetic compounds having sequences of amino and hydroxy carboxylic acid residues (usually α-amino and α-hydroxy acids) connected in a ring. The residues are commonly but not necessarily regularly alternating.
External Descriptors
CHEBI:8732 : cyclodepsipeptide