Compound Identification
SMILES
CCC1COB(O)C1NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)OC(=O)N1CC2=C(C1)C(F)=CC=C2
InChIKey
InChIKey=HWGOWXNMCMMJJK-GSCGEILPSA-N
Formula
C31H44BFN4O8
Mass
630.52
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
-
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 Proline and derivatives Alpha amino acid amides Isoindoles Isoindolines Pyrrolidinecarboxamides N-acylpyrrolidines Aryl fluorides Benzenoids Tertiary carboxylic acid amides Boronic acid esters Carbamate esters Oxaborole derivatives Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organic metalloid salts Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Monoalkylboranes Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Isoindoline - Isoindole - Isoindole or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Benzenoid - Aryl fluoride - Aryl halide - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - 1,2-oxaborole derivative - Boronic acid ester - Secondary carboxylic acid amide - Boronic acid derivative - Carboxamide group - Organic metalloid salt - Organoheterocyclic compound - Oxacycle - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Alkylborane - Monoalkylborane - Organohalogen compound - Carbonyl group - Organic metalloid moeity - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen 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