Structure Information
Structure

Compound Identification

SMILES

CCCC(O)=O.COC1=C2O[C@H]3C(=O)C=C[C@@]4(O)[C@H]5CC(C=C1)=C2[C@@]34CCN5C

InChIKey

InChIKey=IECIECUGKBPDFT-RKXJKUSZSA-N

Formula

C22H27NO6

Mass

401.459

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Morphinans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Morphinans

Alternative Parents

Molecular Framework

Not available

Substituents

Morphinan - Phenanthrene - Isoquinolone - Tetralin - Coumaran - Anisole - Phenol ether - Alkyl aryl ether - Cyclohexenone - Aralkylamine - Piperidine - Straight chain fatty acid - Fatty acyl - Benzenoid - Fatty acid - Tertiary alcohol - Tertiary amine - Tertiary aliphatic amine - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Alcohol - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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

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