Compound Identification
SMILES
CC(C)[C@@H]1NC(=O)N(C)CCC\C=C\CC2=C(C=NN(C3C[C@H](N(C3)C1=O)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)C2=O)C1=CC2=C(C=CS2)C=C1
InChIKey
InChIKey=NMDDAWYIINGICD-JFQGQOJBSA-N
Formula
C39H47N7O7S2
Mass
789.97
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
-
Subclass
Amino acids, peptides, and analogues
-
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
Macrolactams N-acyl-alpha amino acids and derivatives Alpha amino acid amides 1-benzothiophenes Pyrrolidinecarboxamides Pyridazinones Cyclopropanecarboxylic acids and derivatives Benzenoids Organosulfonic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Aminosulfonyl compounds Thiophenes Secondary carboxylic acid amides Lactams Ureas Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzothiophene - 1-benzothiophene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Pyridazinone - Cyclopropanecarboxylic acid or derivatives - Pyridazine - Benzenoid - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Aminosulfonyl compound - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Urea - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Carbonyl group - Organopnictogen compound - Organosulfur compound - 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