Compound Identification
SMILES
COc1ccc2[C@H]3[C@@H](Oc2c1OC)c1c(OC32CCCC2)cc(O[C@@H]2O[C@H]([C@H](OC(=O)CC([O-])=O)[C@H](N)[NH3+])[C@@H](O)[C@H](O)[C@H]2O)cc1-c1ccc(NO)cc1
InChIKey
InChIKey=KCSJEWJSMQOBMY-DGKWPJJYSA-N
Formula
C37H43N3O14
Mass
753.758
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
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Subclass
Furanoisoflavonoids
- Level 5 Pterocarpans
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Subclass
Furanoisoflavonoids
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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 Fatty acyl glycosides of mono- and disaccharides Alkyl glycosides O-glycosyl compounds 1-benzopyrans Benzofurans Coumarans 1-hydroxylamino, 2-unsubstituted benzenoids Anisoles Arylhydroxamates N-phenylhydroxylamines Alkyl aryl ethers Monosaccharides 1,3-dicarbonyl compounds Benzene and substituted derivatives Oxanes Dicarboxylic acids and derivatives Carboxylic acid salts Carboxylic acid esters Secondary alcohols Oxacyclic compounds Carboxylic acids N-organohydroxylamines Acetals Aminals Polyols Organic salts Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organic zwitterions Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavanol - Pterocarpan - Isoflavan - Fatty acyl glycoside of mono- or disaccharide - Fatty acyl glycoside - Phenolic glycoside - Alkyl glycoside - O-glycosyl compound - Glycosyl compound - 1-benzopyran - Chromane - Benzopyran - Coumaran - Benzofuran - N-phenylhydroxylamine - Arylhydroxamate - Anisole - 1-hydroxylamino, 2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Oxane - Monosaccharide - Fatty acyl - Carboxylic acid salt - Secondary alcohol - Carboxylic acid ester - Acetal - Aminal - Oxacycle - N-organohydroxylamine - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Ether - Polyol - Alcohol - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic salt - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - 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
Not available