Compound Identification
SMILES
CCCCCC\C=C\C=C/C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H]1[C@@H](C)OC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](C[C@@H]2CNC(N)=N2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](C[C@@H]2CNC(N)=N2)NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](CCCN)NC(=O)[C@H](NC1=O)C1=CC=C(O)C=C1)[C@@H](C)O)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1)[C@H](C)O)C1=CC=C(O)C=C1)C1=CC(Cl)=C(O)C(Cl)=C1)C1=CC=C(O)C=C1
InChIKey
InChIKey=RPOBXUZBENYQEE-WMLLLZISSA-N
Formula
C106H136Cl2N26O31
Mass
2341.31
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Peptidomimetics
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Subclass
Depsipeptides
- Level 5 Cyclic depsipeptides
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Subclass
Depsipeptides
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Class
Peptidomimetics
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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
Aspartic acid and derivatives Macrolide lactams Alpha amino acid esters N-acyl-alpha amino acids and derivatives Macrolactams Macrolides and analogues Alpha amino acid amides Dichlorobenzenes Imidazolyl carboxylic acids and derivatives O-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Dicarboxylic acids and derivatives N-acyl amines Imidazolines Ureas Secondary carboxylic acid amides Secondary alcohols Amino acids Carboxylic acid esters Guanidines Lactams Lactones Oxacyclic compounds Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Primary alcohols Hydrocarbon derivatives Organochlorides Organic oxides Carbonyl compounds Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cyclic depsipeptide - Aspartic acid or derivatives - Macrolide lactam - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Macrolide - Macrolactam - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 2-halophenol - 2-chlorophenol - 1,3-dichlorobenzene - Imidazolyl carboxylic acid derivative - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Chlorobenzene - Phenol - Aryl chloride - Aryl halide - Fatty acyl - N-acyl-amine - Monocyclic benzene moiety - Fatty amide - Benzenoid - Dicarboxylic acid or derivatives - 2-imidazoline - Carbonic acid derivative - Carboxamide group - Amino acid or derivatives - Lactone - Carboxylic acid ester - Guanidine - Amino acid - Urea - Lactam - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Carboximidamide - Hydrocarbon derivative - Amine - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alcohol - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Aromatic heteromonocyclic 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