Compound Identification
SMILES
CN1CCC2=CC=CC3=C2[C@H]1CC1=C3C(OC(C)=O)=C(OC(C)=O)C=C1
InChIKey
InChIKey=PJAGGJPKGNYFJH-QGZVFWFLSA-N
Formula
C21H21NO4
Mass
351.402
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Aporphines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Aporphines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aporphines
Alternative Parents
Phenanthrenes and derivatives Benzoquinolines Tetrahydroisoquinolines Naphthalenes Aralkylamines Dicarboxylic acids and derivatives Trialkylamines Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aporphine - Benzoquinoline - Phenanthrene - Naphthalene - Quinoline - Tetrahydroisoquinoline - Aralkylamine - Benzenoid - Dicarboxylic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Amine - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aporphines. These are quinoline alkaloids containing the dibenzo[de,g]quinoline ring system or a dehydrogenated derivative thereof.
External Descriptors
Not available