Compound Identification
SMILES
COCCCC1=CC(CN(C2CC2)C(=O)[C@H]2CNCC[C@@]2(OC)C2=CC(=O)N(CCOC3=C(Cl)C=C(C)C=C3Cl)C=C2)=CC(OCCOC)=C1
InChIKey
InChIKey=BMOSALUDXWCWNF-FOEBFOTMSA-N
Formula
C38H49Cl2N3O7
Mass
730.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Piperidinecarboxamides Phenoxy compounds Phenol ethers Dichlorobenzenes Toluenes Pyridinones Alkyl aryl ethers Aralkylamines Dihydropyridines Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Lactams Azacyclic compounds Dialkyl ethers Dialkylamines Organochlorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 3-piperidinecarboxamide - Piperidinecarboxamide - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Halobenzene - Dihydropyridine - Pyridinone - Chlorobenzene - Toluene - Aralkylamine - Alkyl aryl ether - Aryl chloride - Aryl halide - Pyridine - Piperidine - Hydropyridine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Secondary amine - Dialkyl ether - Secondary aliphatic amine - Ether - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic heteromonocyclic 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