Compound Identification
SMILES
COC1CC2N3CCC2(C(OC(C)=O)C1OC(C)=O)C1=CC2=C(OCO2)C(OC)=C1C3
InChIKey
InChIKey=OZMHKPDDXPVORP-UHFFFAOYSA-N
Formula
C22H27NO8
Mass
433.457
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
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
Phenanthridines and derivatives Benzazepines Tetrahydroisoquinolines Indoles and derivatives Benzodioxoles Anisoles Alkyl aryl ethers Aralkylamines Azepines N-alkylpyrrolidines Cyclitols and derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Trialkylamines Amino acids and derivatives Acetals Azacyclic compounds Oxacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hemanthamine/crinine alkaloid skeleton - Phenanthridine - Benzoquinoline - Benzazepine - Quinoline - Tetrahydroisoquinoline - Benzodioxole - Indole or derivatives - Anisole - Aralkylamine - Alkyl aryl ether - Azepine - Cyclitol or derivatives - Benzenoid - N-alkylpyrrolidine - Dicarboxylic acid or derivatives - Pyrrolidine - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - 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