Compound Identification
SMILES
[Gd+3].[O-]C(=O)CN1CCN(CCCCCN2CCN(CC2)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)C(F)(F)C(F)C(F)(F)C(F)(F)F)CCN(CC([O-])=O)CCN(CC([O-])=O)CC1
InChIKey
InChIKey=LXAGEGQGWKUSIP-UHFFFAOYSA-K
Formula
C31H42F15GdN6O8S
Mass
1101.0
Taxonomic Classification
Taxonomy Tree
-
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acids
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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 acids
Alternative Parents
Tricarboxylic acids and derivatives N-alkylpiperazines Organosulfonamides Organic sulfonamides Sulfonyls Trialkylamines Amino acids Carboxylic acid salts Azacyclic compounds Carboxylic acids Organic metal halides Organofluorides Organic zwitterions Carbonyl compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alpha-amino acid - Tricarboxylic acid or derivatives - N-alkylpiperazine - 1,4-diazinane - Piperazine - Organic sulfonic acid amide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Carboxylic acid salt - Amino acid - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid - Organic metal halide - Alkyl halide - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl fluoride - Organic salt - Carbonyl group - Amine - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
External Descriptors
Not available