Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC3CC(N4CCCC4)=C(C4=C(C=C(C=C4[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)C4(O)C5CC(C=C1)=C2C34CCN5C

InChIKey

InChIKey=XCKVKNCHGCJVGC-UHFFFAOYSA-N

Formula

C28H29N5O9

Mass

579.566

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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

Aromatic heteropolycyclic compounds

Substituents

Morphinan - Phenanthrene - Tetralin - Coumaran - Nitrobenzene - Nitroaromatic compound - Anisole - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrrolidine - Tertiary alcohol - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Enamine - Ether - Organic oxoazanium - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic zwitterion - Organic nitrogen 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

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