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Substance Name: 17,17'-(Trisulfanediyldicarbonyl)bis(6alpha,9-difluoro-11beta-hydroxy-16alpha-methyl-3-oxoandrosta-1,4-dien-17alpha-yl) dipropanoate
RN: 960071-64-1
UNII: 13938X01TF
InChIKey: ZJXNXEBDTAODDP-RUXGNHTFSA-N

Molecular Formula

  • C48-H58-F4-O10-S3

Molecular Weight

  • 967.1662
 
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Names and Synonyms

Name of Substance

  • 17,17'-(Trisulfanediyldicarbonyl)bis(6alpha,9-difluoro-11beta-hydroxy-16alpha-methyl-3-oxoandrosta-1,4-dien-17alpha-yl) dipropanoate

Synonym

  • UNII-13938X01TF

Registry Numbers

CAS Registry Number

  • 960071-64-1

FDA UNII

  • 13938X01TF

System Generated Number

  • 0960071641

Structure Descriptors

InChI

1S/C48H58F4O10S3/c1-9-37(57)61-47(23(3)15-27-29-19-33(49)31-17-25(53)11-13-41(31,5)45(29,51)35(55)21-43(27,47)7)39(59)63-65-64-40(60)48(62-38(58)10-2)24(4)16-28-30-20-34(50)32-18-26(54)12-14-42(32,6)46(30,52)36(56)22-44(28,48)8/h11-14,17-18,23-24,27-30,33-36,55-56H,9-10,15-16,19-22H2,1-8H3/t23-,24-,27+,28+,29+,30+,33+,34+,35+,36+,41+,42+,43+,44+,45+,46+,47+,48+/m1/s1

InChIKey

ZJXNXEBDTAODDP-RUXGNHTFSA-N

Smiles

CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)SSSC(=O)[C@@]5(OC(=O)CC)[C@H](C)C[C@H]6[C@@H]7C[C@H](F)C8=CC(=O)C=C[C@]8(C)[C@@]7(F)[C@@H](O)C[C@]56C