Compound Identification
SMILES
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1=NC=CN=C1)B(O)O.CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
InChIKey
InChIKey=QWEZABHALIXTIB-WGFHNGCGSA-N
Formula
C50H68BN7O12
Mass
969.94
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
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Macrolactams N-acyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Pyrazinecarboxamides 2-heteroaryl carboxamides Fatty amides Vinylogous amides Carbamate esters Heteroaromatic compounds Secondary alcohols Cyclic ketones Secondary carboxylic acid amides Boronic acids Lactams Enamines Dialkylamines Dialkyl ethers Azacyclic compounds Organic metalloid salts Hydrocarbon derivatives Organic oxides Monoalkylboranes
Molecular Framework
Not available
Substituents
Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Macrolactam - Alpha-amino acid amide - Amphetamine or derivatives - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - 2-heteroaryl carboxamide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Pyrazine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Cyclic ketone - Secondary carboxylic acid amide - Secondary alcohol - Lactam - Ketone - Carboxamide group - Boronic acid - Boronic acid derivative - Dialkyl ether - Secondary aliphatic amine - Enamine - Ether - Azacycle - Organic metalloid salt - Organoheterocyclic compound - Amine - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Monoalkylborane - Alkylborane - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available