Compound Identification
SMILES
COC1=C(OC)C2=C(C=C1)[C@@H]1[C@@H](OC2=O)C2=CC3=C(OCO3)C=C2CCN1C
InChIKey
InChIKey=XXONLYFUFRQITH-MOPGFXCFSA-N
Formula
C21H21NO6
Mass
383.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Rhoeadine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Rhoeadine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Rhoeadine alkaloids
Alternative Parents
Benzazepines 2-benzopyrans Benzodioxoles Anisoles Azepines Aralkylamines Alkyl aryl ethers Lactones Carboxylic acid esters Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds Acetals Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Rhoeadine-skeleton - Benzazepine - Benzopyran - Isochromane - 2-benzopyran - Benzodioxole - Anisole - Alkyl aryl ether - Azepine - Aralkylamine - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Lactone - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Acetal - Amine - Organopnictogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as rhoeadine alkaloids. These are alkaloids with a structure based on rhoeadine. They usually contain a benzazepine system fused with a six-membered hemiacetal or acetal.
External Descriptors
Not available