Compound Identification
SMILES
COC1=C(O)C=C(O)C(=C1CCC(C)(C)O)C1=COC2=C(C=CC(O)=C2)C1=O
InChIKey
InChIKey=DZZKNTCXUSMJIR-UHFFFAOYSA-N
Formula
C21H22O7
Mass
386.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isoflavonoids
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Subclass
Isoflav-2-enes
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Level 5
Isoflavones
- Level 6 2'-prenylated isoflavones
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Level 5
Isoflavones
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Subclass
Isoflav-2-enes
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Class
Isoflavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-2-enes
Intermediate Tree Nodes
Isoflavones
Direct Parent
2'-prenylated isoflavones
Alternative Parents
3'-O-methylisoflavones Hydroxyisoflavonoids Chromones Methoxyphenols 4-alkoxyphenols Resorcinols Anisoles Phenoxy compounds Methoxybenzenes Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Heteroaromatic compounds Tertiary alcohols Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2'-prenylated isoflavone - 3p-methoxyisoflavone - Hydroxyisoflavonoid - Chromone - Benzopyran - Methoxyphenol - 1-benzopyran - 4-alkoxyphenol - Phenoxy compound - Anisole - Phenol ether - Resorcinol - Methoxybenzene - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyran - Heteroaromatic compound - Tertiary alcohol - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-prenylated isoflavones. These are isoflavones featuring a C5-isoprenoid unit at the 2'-position.
External Descriptors
LIPIDMAPS (LMPK12050070) : Isoflavonoids