Compound Identification
SMILES
CCOC(=O)CC(NCCCCNC(CC(=O)OCC)[C@H]1O[C@@H]2CC(C)(C)C[C@@H]2[C@H]2CC(C)(C)C[C@@H]12)[C@H]1O[C@@H]2CC(C)(C)C[C@@H]2[C@H]2CC(C)(C)C[C@@H]12
InChIKey
InChIKey=WIQFTTLPKGPYGH-SDBMMGTESA-N
Formula
C44H76N2O6
Mass
729.1
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 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Fatty acid esters Oxanes Dicarboxylic acids and derivatives Carboxylic acid esters Oxacyclic compounds Dialkylamines Dialkyl ethers Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Fatty acid ester - Dicarboxylic acid or derivatives - Oxane - Fatty acyl - Carboxylic acid ester - Dialkyl ether - Secondary aliphatic amine - Ether - Secondary amine - Organoheterocyclic compound - Oxacycle - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available