Compound Identification
SMILES
COC1=C2CCCC[C@H](O)[C@@H](O)CC3=CC(=C(O)C=C3)C(=C2)C(OC)=C1OC
InChIKey
InChIKey=NPPMFGQJCBUBDZ-OALUTQOASA-N
Formula
C22H28O6
Mass
388.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
-
Subclass
Cyclic diarylheptanoids
- Level 5 Meta,meta-bridged biphenyls
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Subclass
Cyclic diarylheptanoids
-
Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Cyclic diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Meta,meta-bridged biphenyls
Alternative Parents
Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Secondary alcohols 1,2-diols Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Meta,meta-bridged biphenyl - Anisole - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Benzenoid - Secondary alcohol - 1,2-diol - Ether - Polyol - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position.
External Descriptors
Not available