Compound Identification
SMILES
COC1=CC2=C(C=C1)C1COC3=C(C=CC(OC4OC(CO)C(O)C(O)C4O)=C3)C1O2
InChIKey
InChIKey=PVEMGMOWXQUWRD-UHFFFAOYSA-N
Formula
C22H24O9
Mass
432.425
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
-
Subclass
Furanoisoflavonoids
- Level 5 Pterocarpans
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Subclass
Furanoisoflavonoids
-
Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Furanoisoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
Pterocarpans
Alternative Parents
Isoflavanols Phenolic glycosides Hexoses O-glycosyl compounds 1-benzopyrans Coumarans Benzofurans Anisoles Alkyl aryl ethers Oxanes Secondary alcohols Polyols Oxacyclic compounds Acetals Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavanol - Pterocarpan - Isoflavan - Phenolic glycoside - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Chromane - Benzopyran - 1-benzopyran - Coumaran - Benzofuran - Anisole - Alkyl aryl ether - Oxane - Monosaccharide - Benzenoid - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Ether - Acetal - Primary alcohol - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pterocarpans. These are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids.
External Descriptors
LIPIDMAPS (LMPK12070005) :
Pterocarpans
META CYC (CPD-4122) :
a small molecule