Compound Identification
SMILES
CCC(C)[C@@H]1N(C)C(=O)[C@H](C(C)CC)N(C)C(=O)[C@H](CC(O)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@@H](C)OC(=O)[C@H](CC2=CC=C(OCC3=CC=C(Br)C=C3)C=C2)NC(=O)[C@H](C(C)C)N(C)C(=O)CNC1=O)C(C)C
InChIKey
InChIKey=AZRAOAIWUKQKCZ-XKLSZAFKSA-N
Formula
C63H94BrN9O14
Mass
1281.398
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Isoleucine and derivatives Aspartic acid and derivatives Valine and derivatives N-acyl-alpha amino acids and derivatives Macrolactams Alpha amino acid esters Alpha amino acid amides Piperidinecarboxamides N-acylpiperidines Phenoxy compounds Phenol ethers Fatty acid esters Bromobenzenes Alkyl aryl ethers N-acyl amines Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Lactones Lactams Carboxylic acid esters Vinyl bromides Oxacyclic compounds Carboxylic acids Bromoalkenes Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic depsipeptide - Isoleucine or derivatives - Aspartic acid or derivatives - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Macrolactam - Alpha-amino acid ester - Alpha-amino acid amide - Alpha-amino acid or derivatives - Piperidinecarboxamide - 2-piperidinecarboxamide - N-acyl-piperidine - Phenoxy compound - Phenol ether - Halobenzene - Fatty acid ester - Bromobenzene - Alkyl aryl ether - Fatty acyl - Benzenoid - Piperidine - N-acyl-amine - Fatty amide - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Lactone - Lactam - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen 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
Not available