Compound Identification
SMILES
COC1=C(O)C=CC(=C1)[C@H]1OC2=C(O[C@@H]1CO)C=CC(=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O.CCCCCCCCCCCCCCCCCC(=O)OCC(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
InChIKey
InChIKey=DVVKYRYTKJSPEH-YNHOLTMCSA-N
Formula
C69H110NO18P
Mass
1272.602
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Flavonolignans
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Flavonolignans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Flavonolignans
Alternative Parents
Phosphatidylcholines 3-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Flavanonols Phenylbenzo-1,4-dioxanes Chromones Phosphocholines Benzo-1,4-dioxanes Methoxyphenols Anisoles Aryl alkyl ketones Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty acid esters Dialkyl phosphates 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Para dioxins Dicarboxylic acids and derivatives Tetraalkylammonium salts Vinylogous acids Secondary alcohols Carboxylic acid esters Polyols Oxacyclic compounds Amines Hydrocarbon derivatives Organic oxides Organic salts Primary alcohols Organic cations
Molecular Framework
Not available
Substituents
Flavonolignan - Diacylglycero-3-phosphocholine - 3-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Flavanone - Flavanonol - Phenylbenzodioxane - 2-phenylbenzo-1,4-dioxane - Flavan - Glycero-3-phosphocholine - Phosphocholine - Chromone - Benzo-1,4-dioxane - Benzodioxane - 1-benzopyran - Methoxyphenol - Glycerophospholipid - Chromane - Benzopyran - Phenoxy compound - Phenol ether - Anisole - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Choline - Fatty acid ester - Dialkyl phosphate - Phenol - Phosphoric acid ester - Alkyl phosphate - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Organic phosphoric acid derivative - Para-dioxin - Vinylogous acid - Tetraalkylammonium salt - Quaternary ammonium salt - Ketone - Carboxylic acid ester - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Ether - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic salt - Carbonyl group - Primary alcohol - Organic nitrogen compound - Alcohol - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonolignans. These are non-conventional lignans that derived from flavonoids. They are characterized by a p-dioxin ring substituted at one carbon atom by a C3C6 (phenylpropan) group and fused to the B-ring of the 2-phenylchromene moiety.
External Descriptors
Not available