| Identification | Back Directory | [Name]
ESTRONE 3-O-SULFAMATE | [CAS]
148672-09-7 | [Synonyms]
EMATE
ESTRONE SULFAMATE
ESTRONE O-SULFAMATE
ESTRONE 3-SULFAMATE
ESTRONE 3-O-SULFAMATE
1,3,5(10)-Estratrien-17-one 3-sulfamate
1,3,5[10]-ESTRATRIEN-3-OL-17-ONE SULFAMATE
3-HYDROXY-1,3,5[10]-ESTRATRIEN-17-ONE 3-SULFAMATE
3-[(AMinosulfonyl)oxy]estra-1,3,5(10)-trien-17-one
Estrone 3-sulfamate, Estrone O-Sulfamate, Estrone Sulfamate | [Molecular Formula]
C18H23NO4S | [MDL Number]
MFCD00676965 | [MOL File]
148672-09-7.mol | [Molecular Weight]
349.445 |
| Chemical Properties | Back Directory | [Appearance]
White to Off-White Crystalline Solid | [Melting point ]
195-197°C | [Boiling point ]
530.9±60.0 °C(Predicted) | [density ]
1.314±0.06 g/cm3(Predicted) | [storage temp. ]
−20°C
| [solubility ]
DMSO, Ethanol, Methanol | [form ]
Solid | [pka]
8.86±0.70(Predicted) | [color ]
Pale Beige | [Stability:]
Hygroscopic | [InChIKey]
RVKFQAJIXCZXQY-CBZIJGRNSA-N | [SMILES]
C1(OS(N)(=O)=O)=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(=O)CC3)CC2 |
| Hazard Information | Back Directory | [Chemical Properties]
White to Off-White Crystalline Solid | [Uses]
A potent inhibitor of estrone sulfatase. Inhibits estrone sulfatase >99% at 0.1uM in intact MCF-7 cells, IC50=65pM | [Purification Methods]
Estrone 3-O-sulfamate [148672-09-7] M 349.5. Estrone 3-O-sulfamate is purified by silica gel flash chromatography to give a product with one spot on TLC. It is an active site-directed inhibitor of estrone sulfatase, i.e. a time-dependent enzyme inactivator. [Woo et al. J Med Chem 39 1349 1996, Purohit et al. Biochemistry 34 11508 1995.] |
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| Company Name: |
Energy Chemical
|
| Tel: |
021-58432009 400-005-6266 |
| Website: |
http://www.energy-chemical.com |
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