Compound Identification
SMILES
OC1=CC2=C(C=C1)C1=C3[C@@H](C2)NCCC3=CC2=C1OCO2
InChIKey
InChIKey=LTSPCGWFQLHECP-CYBMUJFWSA-N
Formula
C17H15NO3
Mass
281.311
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 Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Oxacyclic compounds Dialkylamines Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aporphine - Benzoquinoline - Phenanthrene - Naphthalene - Quinoline - Tetrahydroisoquinoline - Benzodioxole - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Benzenoid - Acetal - Secondary aliphatic amine - Oxacycle - Azacycle - Secondary amine - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - 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
CHEBI:2742 :
isoquinoline alkaloid - alkaloid antibiotic
KEGG (C09338) :
Isoquinoline alkaloids