Structure Information
Structure

Compound Identification

SMILES

Cl.[H][C@]1(CO)O[C@]([H])(OC2=CC(O)=CC3=C2C2=C(O)C=CC(=C2)[C@@]2([H])N=C(O)[C@]4([H])N=C(O)[C@@]5([H])N=C(O)[C@]([H])(N=C(O)[C@]([H])(NC)C6=CC(OC7=CC5=C(Cl)C(O)=C7)=C(O)C=C6)C5=CC=C(OC6=C(O[C@]7([H])O[C@]([H])(C(O)=O)[C@@]([H])(O)[C@]([H])(O)[C@@]7([H])N=C(O)CCCCCCCCC(C)C)C(OC7=C(Cl)C=C(C=C7)[C@@]([H])(O)[C@]([H])(N=C2O)C(O)=N[C@]3([H])C(O)=NCCCN(C)C)=CC4=C6)C=C5)[C@@]([H])(O)[C@@]([H])(O)[C@]1([H])O

InChIKey

InChIKey=YKFMAZQRZAMFLK-IJKBFODSSA-N

Formula

C87H99Cl3N10O28

Mass

1839.14

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclic alpha peptide - Saccharolipid - N-acyl-alpha-hexosamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Short-chain hydroxy acid - Piperidinone - Hydroxy fatty acid - Heterocyclic fatty acid - Halogenated fatty acid - Delta-lactam - Branched fatty acid - Beta-hydroxy acid - Fatty acyl - Benzenoid - Pyran - Oxane - Monosaccharide - Hydroxy acid - Cyclic carboximidic acid - Amino acid - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Amino acid or derivatives - Oxacycle - Azacycle - Chloroalkene - Haloalkene - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl chloride - Secondary amine - Polyol - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Alcohol - 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

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