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Chemical structure of 5-Desmethylsinensetin

GC60528

5-Desmethylsinensetin

Also known as 2-(3,4-dimethoxyphenyl)-5-hydroxy-6,7-dimethoxychromen-4-one

5-desmethylsinensetin, isolated from Stevia satureiifolia var

ChemicalCAS21763-80-4MW358.34FormulaC19H18O7
CAS number
21763-80-4
Molecular weight
358.34
Formula
C19H18O7
Solubility
DMSO ： 14·29 mg/mL (39·88 mM; Need ultrasonic)
InChIKey
QEWSAPKRFOFQIU-UHFFFAOYSA-N
Catalogue number
GC60528
Brand
GLPBIO
Computed properties PubChem CID 152430 · XLogP 3.3 · TPSA 83.5 Ų · H-bond donors 1
XLogP
3.3
TPSA
83.5 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
26

SMILES COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OC

Computed descriptors from PubChem (CID 152430), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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