Compound Identification
SMILES
COC1=C(C=CC2=C1CCC(C)(C)O2)C1=CC2=C(OC1)C=C(C=C2)S(C)(=O)=O
InChIKey
InChIKey=FQSBDLOQKRVBDS-UHFFFAOYSA-N
Formula
C22H24O5S
Mass
400.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Pyranoisoflavonoids
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Pyranoisoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
Pyranoisoflavonoids
Alternative Parents
2'-O-methylated isoflavonoids Isoflav-3-enes 2,2-dimethyl-1-benzopyrans Anisoles Alkyl aryl ethers Sulfones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranoisoflavonoid - 2p-methoxyisoflavonoid-skeleton - Isoflav-3-ene skeleton - 2,2-dimethyl-1-benzopyran - Chromane - Benzopyran - 1-benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Sulfonyl - Sulfone - Ether - Organoheterocyclic compound - Oxacycle - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranoisoflavonoids. These are isoflavonoids that contain a pyran ring fused to either of the A, B, or C ring of the isoflavonoid skeleton.
External Descriptors
Not available