Compound Identification
SMILES
OC(C(O)C(O)=O)C(O)=O.COC1=CC2C3CC4=C(C(O)=C(OC)C=C4C4=CC(OC)=C(O)C5=C4CC4C6C=C(OC)C(=O)CC56CCN4C)C2(CCN3C)CC1=O
InChIKey
InChIKey=QWVOXJLNVOZAKM-UHFFFAOYSA-N
Formula
C42H50N2O14
Mass
806.862
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Morphinans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Morphinans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Morphinans
Alternative Parents
Biphenols Phenanthrenes and derivatives Benzazocines Isoquinolones and derivatives Tetralins Anisoles Aralkylamines Beta hydroxy acids and derivatives Short-chain hydroxy acids and derivatives Cyclohexenones Alkyl aryl ethers Sugar acids and derivatives Fatty acids and conjugates Dicarboxylic acids and derivatives Alpha hydroxy acids and derivatives Monosaccharides Piperidines Secondary alcohols 1,2-diols Trialkylamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Not available
Substituents
Morphinan - Biphenol - Phenanthrene - Benzazocine - Isoquinolone - Tetralin - Anisole - Alkyl aryl ether - Cyclohexenone - Beta-hydroxy acid - Aralkylamine - Short-chain hydroxy acid - Sugar acid - Monosaccharide - Alpha-hydroxy acid - Hydroxy acid - Fatty acid - Piperidine - Dicarboxylic acid or derivatives - Benzenoid - Secondary alcohol - Ketone - 1,2-diol - Tertiary amine - Cyclic ketone - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organopnictogen compound - Amine - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as morphinans. These are polycyclic compounds with a four-ring skeleton with three condensed six-member rings forming a partially hydrogenated phenanthrene moiety, one of which is aromatic while the two others are alicyclic.
External Descriptors
Not available