Compound Identification
SMILES
OC(C(O)C(O)=O)C(O)=O.COCCCOC1=C(OC)C=CC(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)=C1
InChIKey
InChIKey=MQSPYGSGJOCQSV-NATPOTRJSA-N
Formula
C34H59N3O12
Mass
701.855
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
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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
Delta amino acids and derivatives
Alternative Parents
Beta amino acids and derivatives Phenylbutylamines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Sugar acids and derivatives Aralkylamines Short-chain hydroxy acids and derivatives Beta hydroxy acids and derivatives Fatty acids and conjugates Dicarboxylic acids and derivatives Alpha hydroxy acids and derivatives Monosaccharides N-acyl amines Secondary carboxylic acid amides 1,2-aminoalcohols Secondary alcohols Primary carboxylic acid amides Dialkyl ethers Carboxylic acids Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Delta amino acid or derivatives - Beta amino acid or derivatives - Phenylbutylamine - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Beta-hydroxy acid - Aralkylamine - Sugar acid - Short-chain hydroxy acid - Alpha-hydroxy acid - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Hydroxy acid - Monosaccharide - N-acyl-amine - Fatty acid - Benzenoid - Secondary carboxylic acid amide - Secondary alcohol - Primary carboxylic acid amide - 1,2-aminoalcohol - Carboxamide group - Ether - Dialkyl ether - Carboxylic acid - Primary aliphatic amine - Organic nitrogen compound - Carbonyl group - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Amine - Organic oxygen compound - Aromatic homomonocyclic 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