Compound Identification
SMILES
OC1=C(O)C=C(C=C1)C(=O)NCCN(CCNC(=O)C1=CC(O)=C(O)C=C1)CC(=O)NC1=CC2=C(SC(=C2)S(=O)(=O)NCP(O)(=O)OC2=CC(F)=C(C=C2)C#N)C=C1
InChIKey
InChIKey=HVDRNWVSLDYRAP-UHFFFAOYSA-N
Formula
C36H34FN6O12PS2
Mass
856.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
-
Level 6
Alpha amino acids and derivatives
-
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
Alpha amino acid amides
Alternative Parents
1-benzothiophenes Benzamides Phenoxy compounds 2,3,5-trisubstituted thiophenes Benzonitriles N-arylamides Benzoyl derivatives Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Fluorobenzenes Phosphonic acid esters Organosulfonamides Aryl fluorides Aminosulfonyl compounds Organic phosphonic acids Heteroaromatic compounds Secondary carboxylic acid amides Trialkylamines Nitriles Organic oxides Organofluorides Hydrocarbon derivatives Carbonyl compounds Organophosphorus compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid amide - Benzothiophene - Benzoic acid or derivatives - 1-benzothiophene - Benzamide - Catechol - Benzoyl - Phenoxy compound - Benzonitrile - N-arylamide - 2,3,5-trisubstituted thiophene - Phenol - Fluorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - 1-hydroxy-4-unsubstituted benzenoid - Benzenoid - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Organosulfonic acid amide - Phosphonic acid ester - Organophosphonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Thiophene - Aminosulfonyl compound - Organophosphonic acid derivative - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carbonitrile - Nitrile - Organoheterocyclic compound - Organofluoride - Organosulfur compound - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Organophosphorus compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organooxygen compound - Organohalogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors
Not available