Compound Identification
SMILES
CC1=C(C)C(C)=C(C=C1)S(=O)(=O)N[C@](CCCN=C(N)N)(OCC1=CC=CC=C1)C(=O)C1C(=O)N([C@@H](C(OCC2=CC=CC=C2)C(O)=O)C(=O)N[C@@](CCCCN)(C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)C1=O
InChIKey
InChIKey=CMZXUTAQOJVUMS-SLXBTNOSSA-N
Formula
C54H67N7O14S
Mass
1070.23
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 Aspartic acid 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
Aspartic acid and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives N-linked disaccharides Benzenesulfonamides Benzyloxycarbonyls Tricarboxylic acids and derivatives Benzenesulfonyl compounds Benzylethers Fatty acid esters Organosulfonamides N-acyl amines 1,3-dicarbonyl compounds Aminosulfonyl compounds Beta lactams Dicarboximides Secondary carboxylic acid amides Azetidines Amino acids Ketones Tertiary amines Carboxylic acid esters Guanidines Azacyclic compounds Carboximidamides Carboxylic acids Dialkyl ethers Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aspartic acid or derivatives - N-acyl-alpha amino acid or derivatives - Disaccharide - N-linked disaccharide - Benzyloxycarbonyl - Benzenesulfonamide - Benzenesulfonyl group - Benzylether - Tricarboxylic acid or derivatives - Fatty acid ester - N-acyl-amine - Organosulfonic acid amide - Fatty acyl - Fatty amide - Benzenoid - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Beta-lactam - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Dicarboximide - Sulfonyl - Aminosulfonyl compound - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ketone - Azetidine - Amino acid - Guanidine - Tertiary amine - Lactam - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Dialkyl ether - Carboximidamide - Ether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available