Compound Identification
SMILES
OC(C(=O)[C@H]1O[C@H](O)[C@](O)(C(=O)C2=CC=CC=C2)[C@@]1(O)C(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=MFAMKJZRBODDRP-VPPRKQAVSA-N
Formula
C26H22O8
Mass
462.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
-
Class
Furanoid lignans
-
Subclass
Tetrahydrofuran lignans
-
Level 5
9,9'-epoxylignans
- Level 6 Dibenzylbutyrolactols
-
Level 5
9,9'-epoxylignans
-
Subclass
Tetrahydrofuran lignans
-
Class
Furanoid lignans
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Furanoid lignans
Subclass
Tetrahydrofuran lignans
Intermediate Tree Nodes
9,9'-epoxylignans
Direct Parent
Dibenzylbutyrolactols
Alternative Parents
Alkyl-phenylketones Pentoses Benzoyl derivatives Aryl alkyl ketones Acyloins Tertiary alcohols Oxolanes Alpha-hydroxy ketones Secondary alcohols Hemiacetals 1,2-diols Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dibenzylbutyrolactol - Alkyl-phenylketone - Pentose monosaccharide - Phenylketone - Benzoyl - Aryl ketone - Aryl alkyl ketone - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Acyloin - Tertiary alcohol - Alpha-hydroxy ketone - Oxolane - Secondary alcohol - 1,2-diol - Hemiacetal - Ketone - Organoheterocyclic compound - Oxacycle - Polyol - Aromatic alcohol - Organic oxygen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzylbutyrolactols. These are lignan compounds containing a 3,4-dibenzyloxolan-2-ol moiety.
External Descriptors
Not available