Compound Identification
SMILES
CCOC1=C(OCC(=O)NC2=CC=C(F)C=C2)C(I)=CC(C=C2SC(=O)N(CC(=O)N3CCCCCC3)C2=O)=C1
InChIKey
InChIKey=SWCNFBPIWFXQHN-UHFFFAOYSA-N
Formula
C28H29FIN3O6S
Mass
681.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Anilides N-arylamides Phenol ethers Phenoxy compounds Alkyl aryl ethers Azepanes Fluorobenzenes Iodobenzenes Thiazolidinediones Aryl iodides Aryl fluorides Dicarboximides Tertiary carboxylic acid amides Organic carbonic acids and derivatives Thiocarbamic acid derivatives Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organofluorides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Anilide - Phenoxy compound - Phenol ether - N-arylamide - Alkyl aryl ether - Iodobenzene - Halobenzene - Azepane - Fluorobenzene - Thiazolidinedione - Aryl fluoride - Aryl halide - Aryl iodide - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Thiazolidine - Dicarboximide - Carboxamide group - Thiocarbamic acid derivative - Secondary carboxylic acid amide - Carbonic acid derivative - Ether - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organohalogen compound - Organofluoride - Organoiodide - Aromatic heteromonocyclic 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