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Substance Name: Tetrahydrocortisone 3,21-diacetate
RN: 28439-40-9
InChIKey: PXQRJZNDFRAFTF-BQCMLFGMSA-N

Molecular Formula

  • C25-H36-O7

Molecular Weight

  • 448.5524
 
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Names and Synonyms

Name of Substance

  • Tetrahydrocortisone 3,21-diacetate

Synonym

  • EINECS 249-018-2

Systematic Name

  • 3alpha,17,21-Trihydroxy-5beta-pregnane-11,20-dione 3,21-di(acetate)

Registry Numbers

CAS Registry Number

  • 28439-40-9

System Generated Number

  • 0028439409

Structure Descriptors

InChI

1S/C25H36O7/c1-14(26)31-13-21(29)25(30)10-8-19-18-6-5-16-11-17(32-15(2)27)7-9-23(16,3)22(18)20(28)12-24(19,25)4/h16-19,22,30H,5-13H2,1-4H3/t16-,17-,18+,19+,22-,23+,24+,25+/m1/s1

InChIKey

PXQRJZNDFRAFTF-BQCMLFGMSA-N

Smiles

CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)OC(=O)C)C)C)O