Compound Identification
SMILES
CC[C@@]1(OC(=O)CCC(F)(F)CN([C@@H](CCCNC(N)=O)C(N)=O)C(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)C(=O)OCC2=C1C=C1C3NC4=C(CC3CN1C2=O)C(Br)=CC=C4
InChIKey
InChIKey=XVQDIHLSOVXZJR-MHNCWWFUSA-N
Formula
C46H57BrF2N8O11
Mass
1015.908
Taxonomic Classification
Taxonomy Tree
-
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
-
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
Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Pyranopyridines Hydroquinolines Aralkylamines Secondary alkylarylamines Pyridinones Fatty acid esters Maleimides Aryl bromides Benzenoids Dicarboxylic acids and derivatives N-acyl amines N-substituted carboxylic acid imides Tertiary carboxylic acid amides Pyrrolines Dicarboximides Heteroaromatic compounds Lactams Secondary carboxylic acid amides Primary carboxylic acid amides Carboxylic acid esters Ureas Lactones Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organofluorides Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Pyranopyridine - Tetrahydroquinoline - Secondary aliphatic/aromatic amine - Pyridinone - Maleimide - Aralkylamine - Fatty acid ester - N-acyl-amine - Benzenoid - Pyridine - Aryl halide - Aryl bromide - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrroline - Secondary carboxylic acid amide - Primary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Urea - Lactone - Lactam - Carboxylic acid ester - Secondary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Amine - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organohalogen compound - Organooxygen compound - Organobromide - Organofluoride - Organonitrogen 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