Compound Identification
SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)OC4=C(C=O)C(C=O)=CC(O)=C4C[C@H]23)C1(C)C
InChIKey
InChIKey=VLZYABSANJBETG-KOSDUOMESA-N
Formula
C25H32O6
Mass
428.525
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isoflavonoids
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Subclass
Isoflavans
- Level 5 Isoflavanols
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Subclass
Isoflavans
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Class
Isoflavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavanols
Alternative Parents
Xanthenes Naphthopyrans Naphthalenes Aryl-aldehydes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Pyrans Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavanol - Dibenzopyran - Xanthene - Naphthopyran - Chromane - Benzopyran - Naphthalene - 1-benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Aryl-aldehyde - Benzenoid - Pyran - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Oxacycle - Carboxylic acid derivative - Aldehyde - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavanols. These are polycyclic compounds containing a hydroxylated isoflavan skeleton.
External Descriptors
Not available