Structure Information
Structure

Compound Identification

SMILES

OC1CN2CC3=CC4=C(OCO4)C=C3[C@]11C=C[C@H](O)CC21

InChIKey

InChIKey=KWAOMPWGIIXDPH-BETYQYEDSA-N

Formula

C16H17NO4

Mass

287.315

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Amaryllidaceae alkaloids

Subclass

Crinine- and Haemanthamine-type amaryllidaceae alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

Crinine- and Haemanthamine-type amaryllidaceae alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hemanthamine/crinine alkaloid skeleton - Benzoquinoline - Phenanthridine - Benzazepine - Quinoline - Tetrahydroisoquinoline - Benzodioxole - Indole or derivatives - Azepine - Aralkylamine - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Tertiary aliphatic amine - 1,2-aminoalcohol - Secondary alcohol - Tertiary amine - Oxacycle - Organoheterocyclic compound - Acetal - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as crinine- and haemanthamine-type amaryllidaceae alkaloids. These are amaryllidaceae alkaloids compounds with a structure based on the crinine or haemanthamine backbone. Both backbones have a common 5,10b-ethano bridge moiety in their frameworks, which is a very significant taxonomic feature, and the configurations of the 5,10b-ethano bridge are opposite to each other.

External Descriptors

Not available

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