Compound Identification
SMILES
COC1=C(OC)C2=C(C=CC3C=CC=CC23)C(CC[N+](C)(C)[O-])=C1
InChIKey
InChIKey=JXRWQIQJOZZSLA-UHFFFAOYSA-N
Formula
C20H25NO3
Mass
327.424
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class 6,6a-secoaporphines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
6,6a-secoaporphines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
6,6a-secoaporphines
Alternative Parents
Hydrophenanthrenes Naphthalenes Anisoles Alkyl aryl ethers Trialkyl amine oxides Trisubstituted amine oxides and derivatives Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
6,6a-secoaporphine - Hydrophenanthrene - Phenanthrene - Naphthalene - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Trialkyl amine oxide - Trisubstituted n-oxide - N-oxide - Ether - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6,6a-secoaporphines. These are alkaloids with a structure that contains an aminoethylphenanthrene moiety.
External Descriptors
Not available