Compound Identification
SMILES
COC1=CC(C[C@H](NC(=O)CC2=CC(OC3=CC=CC=C3)=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)B2O[C@@H]3C[C@@H]4C[C@@H](C4(C)C)[C@]3(C)O2)=CC(OC)=C1OC
InChIKey
InChIKey=LIUOLEABGUEJPE-PFHRAVFRSA-N
Formula
C46H62BN3O9
Mass
811.82
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
Phenylalanine and derivatives Valine and derivatives N-acyl-alpha amino acids and derivatives Diphenylethers Alpha amino acid amides Diarylethers Phenylacetamides Amphetamines and derivatives Aromatic monoterpenoids Bicyclic monoterpenoids Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers N-acyl amines Boronic acid esters Dioxaborolanes Secondary carboxylic acid amides Organic metalloid salts Oxacyclic compounds Carbonyl compounds Monoalkylboranes Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Diphenylether - Valine or derivatives - Alpha-amino acid amide - Diaryl ether - Phenylacetamide - Monoterpenoid - Pinane monoterpenoid - Nopinane monoterpenoid - Aromatic monoterpenoid - Amphetamine or derivatives - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Phenol ether - Anisole - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - N-acyl-amine - 1,3,2-dioxaborolane - Boronic acid ester - Secondary carboxylic acid amide - Carboxamide group - Boronic acid derivative - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Ether - Organooxygen compound - Monoalkylborane - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Carbonyl group - Organic metalloid moeity - Alkylborane - 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