Compound Identification
SMILES
Cl.COC1=C(O)C=C2C[C@@H]3NCCC4=CC5=C(OCO5)C(C2=C1)=C34
InChIKey
InChIKey=XMTMKYRPVQCDQH-YDALLXLXSA-N
Formula
C18H18ClNO4
Mass
347.8
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 Benzodioxoles Anisoles 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Oxacyclic compounds Acetals Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organopnictogen compounds Hydrochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aporphine - Benzoquinoline - Phenanthrene - Naphthalene - Quinoline - Tetrahydroisoquinoline - Benzodioxole - Anisole - Aralkylamine - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Azacycle - Oxacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Acetal - Ether - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrochloride - 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