Compound Identification
SMILES
COC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC(=O)N1CCC2(CC1)OCCO2)C(C)C
InChIKey
InChIKey=JFHQEBNZBZHQFQ-GOSISDBHSA-N
Formula
C20H30N2O6S
Mass
426.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
Azaspirodecane derivatives Benzenesulfonamides Benzenesulfonyl compounds N-acylpiperidines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Ketals Organosulfonamides 1,3-dioxolanes Tertiary carboxylic acid amides Aminosulfonyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Benzenesulfonamide - Azaspirodecane - N-acyl-piperidine - Benzenesulfonyl group - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Alkyl aryl ether - Ketal - Piperidine - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Meta-dioxolane - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic 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