Compound Identification
SMILES
CC(C)[C@H](C[C@H](O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC[N+]1([O-])CCOCC1
InChIKey
InChIKey=IADQLJXRCOEKRC-UFYCRDLUSA-N
Formula
C21H35N3O4
Mass
393.528
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- 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
Direct Parent
Delta amino acids and derivatives
Alternative Parents
Amphetamines and derivatives Aralkylamines Morpholines N-acyl amines Trialkyl amine oxides 1,2-aminoalcohols Secondary carboxylic acid amides Secondary alcohols Trisubstituted amine oxides and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic zwitterions Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic salts Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Delta amino acid or derivatives - Amphetamine or derivatives - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Morpholine - Fatty acyl - N-acyl-amine - Oxazinane - Benzenoid - Trialkyl amine oxide - Carboxamide group - 1,2-aminoalcohol - Secondary alcohol - Secondary carboxylic acid amide - N-oxide - Trisubstituted n-oxide - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic salt - Primary aliphatic amine - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Amine - Primary amine - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available