Compound Identification
SMILES
CCCC(NC(=O)[C@@H]1CC2(CN1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)SCCCS2)C(=O)C(=O)NCC(=O)N[C@H](C(=O)N(C)C)C1=CC=CC=C1
InChIKey
InChIKey=IANDMVKFJFCVEI-HQTXQMFDSA-N
Formula
C39H58N6O8S2
Mass
803.05
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 Dipeptides
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Level 5
Peptides
-
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
Dipeptides
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylacetamides Azaspirodecane derivatives Pyrrolidinecarboxamides N-acylpyrrolidines Dithioketals N-acyl amines Dithianes Tertiary carboxylic acid amides Carbamate esters Secondary carboxylic acid amides Ketones Azacyclic compounds Dialkylthioethers Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Azaspirodecane - Phenylacetamide - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Dithioketal - Fatty amide - N-acyl-amine - Monocyclic benzene moiety - 1,3-dithiane - Fatty acyl - Benzenoid - Thioacetal - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Ketone - Carboxamide group - Secondary carboxylic acid amide - Thioether - Dialkylthioether - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available