Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)O[C@H]1CC23CCNC22C[C@@H](OC2(OC)[C@H]1O)C1=CC2=C(OCO2)C=C31
InChIKey
InChIKey=FQTGWQFUPQBOJP-UHPCZMERSA-N
Formula
C27H29NO9
Mass
511.527
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Hasubanan alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Hasubanan alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Hasubanan alkaloids
Alternative Parents
Phenanthrenes and derivatives P-methoxybenzoic acids and derivatives M-methoxybenzoic acids and derivatives Tetralins Dimethoxybenzenes Benzoic acid esters Indolines Benzodioxoles Phenoxy compounds Benzoyl derivatives Anisoles Ketals Aralkylamines Alkyl aryl ethers Tetrahydrofurans Pyrrolidines Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hasubanan skeleton - Phenanthrene - P-methoxybenzoic acid or derivatives - M-methoxybenzoic acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Tetralin - Benzoate ester - Dihydroindole - Indole or derivatives - Benzoic acid or derivatives - Benzodioxole - Phenoxy compound - Methoxybenzene - Phenol ether - Benzoyl - Anisole - Ketal - Aralkylamine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Tetrahydrofuran - Pyrrolidine - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hasubanan alkaloids. These are alkaloids with a structure based on the hasubanan skeleton, a tetracyclic propellane.
External Descriptors
Not available