Compound Identification
SMILES
CN1[C@@H]2CC[C@H]1C1=C(OC(C)=C(C)C1=O)[C@H]2O
InChIKey
InChIKey=UAARLJVWSXEVAB-SBMIAAHKSA-N
Formula
C13H17NO3
Mass
235.283
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Cycloheptapyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Cycloheptapyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cycloheptapyrans
Alternative Parents
Pyranones and derivatives Aralkylamines N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptapyran - Pyranone - Aralkylamine - Pyran - N-alkylpyrrolidine - Heteroaromatic compound - Pyrrolidine - 1,2-aminoalcohol - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cycloheptapyrans. These are organic heterocyclic compounds containing a cycloheptane derivative fused to a pyran. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.
External Descriptors
Not available