Structure Information
Structure

Compound Identification

SMILES

CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H]2COC(=O)CN2C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C

InChIKey

InChIKey=HHEYUNKLXXHSIX-LLYUJRLRSA-N

Formula

C64H111N11O14

Mass

1258.655

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Peptidomimetics

Subclass

Peptoid-peptide hybrids

Intermediate Tree Nodes

Not available

Direct Parent

Cyclosporins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cyclosporin-backbone - Cyclic depsipeptide - Depsipeptide - Macrolide lactam - Alpha-amino acid ester - Macrolactam - Alpha-amino acid or derivatives - Morpholine - Oxazinane - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Secondary carboxylic acid amide - Secondary alcohol - Azacycle - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclosporins. These are cyclic depsipeptides containing the cyclosporin backbone.

External Descriptors

Not available

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