Compound Identification
SMILES
CCC(C)CC(C)CCCCCCCCC(O)=NC1CC(O)C(O)N=C(O)C2C(O)CCN2C(=O)C(N=C(O)C(N=C(O)C2CC(O)CN2C(=O)C(N=C1O)C(C)O)C(O)C(O)C1=CC=C(OC(O)=NCC(O)=O)C=C1)C(O)CC(O)=N
InChIKey
InChIKey=BACCQVKLPDHVKB-UHFFFAOYSA-N
Formula
C53H83N9O20
Mass
1166.29
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
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Peptides
- Level 6 Cyclic peptides
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Level 5
Peptides
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Alpha amino acids and derivatives Phenoxy compounds Tertiary carboxylic acid amides Pyrrolidines Cyclic carboximidic acids Secondary alcohols Lactams Alkanolamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Polyols Carbonyl compounds Hydrocarbon derivatives Organic oxides Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Alpha-amino acid or derivatives - Phenoxy compound - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Cyclic carboximidic acid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Secondary alcohol - Alkanolamine - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Polyol - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Organic oxide - Aromatic 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