Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(CC1=CC=CC=C1)C(=O)NCC1=CC=CC(=C1)C1=CC(=CC=C1)C1OC(CN2CCN(CC2)C2=CC=C(C=C2)[N+]([O-])=O)CC(O1)C1=CC=C(CO)C=C1
InChIKey
InChIKey=IVPZEUOREMQGQM-UHFFFAOYSA-N
Formula
C51H53N5O8S
Mass
896.07
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
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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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Biphenyls and derivatives N-arylpiperazines Phenylpiperazines Alpha amino acid amides P-toluenesulfonamides Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Aniline and substituted anilines Nitroaromatic compounds Benzyl alcohols Dialkylarylamines Aralkylamines N-alkylpiperazines Organosulfonamides Fatty amides 1,3-dioxanes Aminosulfonyl compounds Trialkylamines Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Acetals Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Aromatic alcohols Organic salts Organic zwitterions Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - N-arylpiperazine - Phenylpiperazine - Alpha-amino acid amide - Biphenyl - P-toluenesulfonamide - Tosyl compound - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Benzyl alcohol - Tertiary aliphatic/aromatic amine - Nitroaromatic compound - Dialkylarylamine - Aniline or substituted anilines - Toluene - N-alkylpiperazine - Aralkylamine - Fatty amide - Piperazine - Benzenoid - Meta-dioxane - Monocyclic benzene moiety - Organosulfonic acid amide - Fatty acyl - 1,4-diazinane - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Azacycle - Acetal - Organic oxoazanium - Organoheterocyclic compound - Organopnictogen compound - Alcohol - Organic salt - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary alcohol - Organic zwitterion - Aromatic alcohol - Amine - Aromatic heteromonocyclic 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