Compound Identification
SMILES
[Na+].[Na+].CN1N(C(=O)C(CNCS([O-])(=O)=O)=C1C)C1=CC=CC=C1.CN1N(C(=O)C(CNCS([O-])(=O)=O)=C1C)C1=CC=CC=C1.CCN(CC)CCNC(C(=O)OCCC(C)C)C1=CC=CC=C1
InChIKey
InChIKey=ZRJWSNYGAHWWNL-UHFFFAOYSA-L
Formula
C45H64N8Na2O10S2
Mass
987.15
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 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
Phenylpyrazoles Aralkylamines Pyrazolones Benzene and substituted derivatives Vinylogous amides Alkanesulfonic acids Sulfonyls Organosulfonic acids Heteroaromatic compounds Trialkylamines Carboxylic acid esters Lactams Dialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds Organic sodium salts Organic cations
Molecular Framework
Not available
Substituents
Alpha-amino acid ester - Phenylpyrazole - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Pyrazolinone - Sulfonyl - Alkanesulfonic acid - Organosulfonic acid - Azole - Heteroaromatic compound - Pyrazole - Organic sulfonic acid or derivatives - Vinylogous amide - Organosulfonic acid or derivatives - Carboxylic acid ester - Lactam - Tertiary amine - Tertiary aliphatic amine - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Azacycle - Organic alkali metal salt - Secondary amine - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organic sodium salt - Organopnictogen compound - Carbonyl group - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available