Compound Identification
SMILES
COC1=C(O)C2=C(CC3C4=C(CC[N+]3(C)[O-])C=CC(OC)=C4O2)C=C1
InChIKey
InChIKey=SUTPKKPHQKUBNR-UHFFFAOYSA-N
Formula
C19H21NO5
Mass
343.379
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Cularin alkaloids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cularin alkaloids and derivatives
Alternative Parents
Dibenzoxepines Diarylethers Tetrahydroisoquinolines Anisoles Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Trialkyl amine oxides Trisubstituted amine oxides and derivatives Oxacyclic compounds Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cularin or derivatives - Dibenzoxepine - Diaryl ether - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Benzenoid - Trialkyl amine oxide - N-oxide - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Trisubstituted n-oxide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organic salt - Hydrocarbon derivative - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cularin alkaloids and derivatives. These are derivatives of benzyl isoquinolines in which a phenolic oxygen is incorporated into a seven-membered ring.
External Descriptors
Not available