Compound Identification
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CCC(C)CCN1CC[C@@]23CCCC[C@H]2[C@@H]1CC1=C3C=C(OC)C=C1
InChIKey
InChIKey=IATJMLPKUHHHKY-UMJSXZRBSA-N
Formula
C27H41NO7
Mass
491.625
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
Phenanthrenes and derivatives Benzazocines Tetralins Anisoles Alkyl aryl ethers Sugar acids and derivatives Short-chain hydroxy acids and derivatives Aralkylamines Beta hydroxy acids and derivatives Alpha hydroxy acids and derivatives Piperidines Monosaccharides Dicarboxylic acids and derivatives Fatty acids and conjugates 1,2-diols Secondary alcohols Trialkylamines Azacyclic compounds Carboxylic acids Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Morphinan - Phenanthrene - Benzazocine - Tetralin - Anisole - Phenol ether - Alkyl aryl ether - Beta-hydroxy acid - Aralkylamine - Short-chain hydroxy acid - Sugar acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Fatty acid - Piperidine - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-diol - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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