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Chemical structure of 3-Formylsalicylic Acid

GC18462

3-Formylsalicylic Acid

Also known as 3-formyl-2-hydroxybenzoic acid

3-Formylsalicylic acid is a non-competitive inhibitor of estrone sulfatase (IC50 = 150 nM; Ki = 120 nM), the enzyme that converts estrone sulfate to estrone

ChemicalCAS610-04-8MW166.1FormulaC8H6O4
CAS number
610-04-8
Molecular weight
166.1
Formula
C8H6O4
Solubility
Soluble in DMSO
InChIKey
YOEUNKPREOJHBW-UHFFFAOYSA-N
Catalogue number
GC18462
Brand
GLPBIO
Computed properties PubChem CID 69117 · XLogP 1 · TPSA 74.6 Ų · H-bond donors 2
XLogP
1
TPSA
74.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
12

SMILES C1=CC(=C(C(=C1)C(=O)O)O)C=O

Computed descriptors from PubChem (CID 69117), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
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