Compound Identification
SMILES
COC1=CC2=C(C=C1)C(O[C@@H]1C[C@H](N(C1)C(=O)C(NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)P(O)(=O)CC1=CC=CS1)=CC(=N2)C1=CSC(NC(C)C)=N1
InChIKey
InChIKey=BFRUVPBKMAIPLT-ZFJUYLAZSA-N
Formula
C43H55N6O8PS2
Mass
879.04
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
Valine and derivatives Proline and derivatives Alpha amino acid amides Quinolines and derivatives Anisoles N-acylpyrrolidines Pyrrolidinecarboxamides 2,4-disubstituted thiazoles Alkyl aryl ethers 2-amino-1,3-thiazoles Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Thiophenes Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Quinoline - Anisole - N-acylpyrrolidine - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - 1,3-thiazol-2-amine - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Carbamic acid ester - Thiophene - Pyrrolidine - Thiazole - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Ether - Organoheterocyclic compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Amine - Hydrocarbon derivative - 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