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Substance Name: Estradiol 3,17-divalerate
RN: 63042-28-4
UNII: EQ443E73KN
InChIKey: XCWCTQWBFLVNMT-RIWVVKKCSA-N

Molecular Weight

  • 440.62
 
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Names and Synonyms

Name of Substance

  • Estradiol 3,17-divalerate

Synonyms

  • Estra-1,3,5(10)-trien-3,17beta-diyl dipentanoate
  • Estra-1,3,5(10)-triene-3,17-diol (17beta)-, 3,17-dipentanoate
  • Estradiol 3,17-divalerate
  • Estradiol valerate impurity E [EP]
  • Estradiol, divalerate
  • UNII-EQ443E73KN

Registry Numbers

CAS Registry Number

  • 63042-28-4

FDA UNII

  • EQ443E73KN

System Generated Number

  • 0063042284

Structure Descriptors

InChI

1S/C28H40O4/c1-4-6-8-26(29)31-20-11-13-21-19(18-20)10-12-23-22(21)16-17-28(3)24(23)14-15-25(28)32-27(30)9-7-5-2/h11,13,18,22-25H,4-10,12,14-17H2,1-3H3/t22-,23-,24+,25+,28+/m1/s1

InChIKey

XCWCTQWBFLVNMT-RIWVVKKCSA-N

Smiles

CCCCC(=O)Oc1ccc2c(c1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OC(=O)CCCC)C