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Substance Name: Testosterone glucuronate
RN: 1180-25-2
InChIKey: NIKZPECGCSUSBV-HMAFJQTKSA-N

Note

  • Natural conjugate isolated from human plasma.

Molecular Formula

  • C25-H36-O8

Molecular Weight

  • 464.551
 
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Names and Synonyms

Name of Substance

  • Testosterone glucuronate

Synonyms

  • Epitestosterone glucuronide
  • NSC 92192
  • Testosterone 17-glucosiduronate
  • Testosterone glucuronate
  • Testosterone glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (17beta)-3-oxoandrost-4-en-17-yl

Registry Numbers

CAS Registry Number

  • 1180-25-2

System Generated Number

  • 0001180252

Structure Descriptors

InChI

1S/C25H36O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h11,14-21,23,27-29H,3-10H2,1-2H3,(H,30,31)/t14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1

InChIKey

NIKZPECGCSUSBV-HMAFJQTKSA-N

Smiles

C1C(=O)C=C2[C@@](C)(C1)[C@@H]1[C@@H](CC2)[C@@H]2CC[C@@H](O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(O)=O)O)O)O)[C@@]2(C)CC1