Compound Identification
SMILES
C\C=C(\C)C(=O)OC1CC[N+]2([O-])CC=C(COC(=O)C(O)(C(C)O)C(C)(C)O)C12
InChIKey
InChIKey=KDJGEXAPDZNXSD-SDQBBNPISA-N
Formula
C20H31NO8
Mass
413.467
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Not available
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Alkaloids and derivatives
Alternative Parents
Pyrrolizines Beta hydroxy acids and derivatives Fatty acid esters Dicarboxylic acids and derivatives N-alkylpyrrolidines Trialkyl amine oxides Enoate esters Tertiary alcohols Pyrrolines Secondary alcohols Trisubstituted amine oxides and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alkaloid or derivatives - Pyrrolizine - Beta-hydroxy acid - Fatty acid ester - Dicarboxylic acid or derivatives - Hydroxy acid - N-alkylpyrrolidine - Fatty acyl - Trialkyl amine oxide - Pyrrolidine - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrroline - Tertiary alcohol - Carboxylic acid ester - Secondary alcohol - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - N-oxide - Trisubstituted n-oxide - Organic oxide - Organic zwitterion - Organic salt - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkaloids and derivatives. These are naturally occurring chemical compounds that contain mostly basic nitrogen atoms. This group also includes some related compounds with neutral and even weakly acidic properties. Also some synthetic compounds of similar structure are attributed to alkaloids. In addition to carbon, hydrogen and nitrogen, alkaloids may also contain oxygen, sulfur and more rarely other elements such as chlorine, bromine, and phosphorus.
External Descriptors
Not available