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Substance Name: SR 16157
RN: 943344-76-1
InChIKey: ASNNHMZDKNSENI-JPUMNTSPSA-N

Note

  • An estrone sulfatase inhibitor and hormonal antineoplastic agent.

Molecular Formula

  • C27-H44-N2-O4-S

Molecular Weight

  • 492.7206
 
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Names and Synonyms

Results Name

  • SR 16157

Synonym

  • SR 16157

Systematic Name

  • 19-Norpregna-1,3,5(10)-trien-3-ol, 21-(2-(diethylamino)ethoxy)-7-methyl-, 3-sulfamate, (7alpha)-

Registry Numbers

CAS Registry Number

  • 943344-76-1

System Generated Number

  • 0943344761

Structure Descriptors

InChI

1S/C27H44N2O4S/c1-5-29(6-2)14-16-32-15-12-21-7-10-25-26-19(3)17-20-18-22(33-34(28,30)31)8-9-23(20)24(26)11-13-27(21,25)4/h8-9,18-19,21,24-26H,5-7,10-17H2,1-4H3,(H2,28,30,31)/t19-,21-,24?,25?,26?,27?/m1/s1

InChIKey

ASNNHMZDKNSENI-JPUMNTSPSA-N

Smiles

CCN(CC)CCOCC[C@H]1CCC2C3[C@H](C)Cc4cc(OS(=O)(=O)N)ccc4C3CCC12C