Compound Identification
SMILES
COC(C)C(O)(C(C)C)C(=O)OCC1=CC[N+]2([O-])CC[C@H](O)[C@H]12
InChIKey
InChIKey=QSTHEUSPIBEICI-ORJSOOTCSA-N
Formula
C16H27NO6
Mass
329.393
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 Fatty acid esters N-alkylpyrrolidines Tertiary alcohols Pyrrolines Trialkyl amine oxides Secondary alcohols Carboxylic acid esters Trisubstituted amine oxides and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Dialkyl ethers Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alkaloid or derivatives - Pyrrolizine - Fatty acid ester - N-alkylpyrrolidine - Fatty acyl - Pyrrolidine - Pyrroline - Trialkyl amine oxide - Tertiary alcohol - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - N-oxide - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Trisubstituted n-oxide - Azacycle - Organonitrogen compound - Alcohol - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic zwitterion - 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