Compound Identification
SMILES
CCCOC1=C2CCC3(CCN(CC3)C3=NC=C(S3)C3=NN(CC(O)=O)N=N3)OC2=C(C=C1)C(OC1=CC=CC2=C1CCC1(CCN(CC1)C1=NC=C(S1)C1=NN(CC(O)=O)N=N1)O2)C1=CC(F)=C(F)C=C1
InChIKey
InChIKey=KCDUSWNTHNXTFT-UHFFFAOYSA-N
Formula
C48H48F2N12O8S2
Mass
1023.1
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
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
1-benzopyrans Phenol ethers Dialkylarylamines 2,5-disubstituted thiazoles Alkyl aryl ethers Fluorobenzenes Piperidines 2-amino-1,3-thiazoles Aryl fluorides Dicarboxylic acids and derivatives Tetrazoles Heteroaromatic compounds Carboxylic acids Azacyclic compounds Oxacyclic compounds Organofluorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzopyran - Chromane - 1-benzopyran - Phenol ether - Dialkylarylamine - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Dicarboxylic acid or derivatives - Aryl halide - 1,3-thiazol-2-amine - Benzenoid - Monocyclic benzene moiety - Piperidine - Tetrazole - Thiazole - Heteroaromatic compound - Azole - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Ether - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available