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Substance Name: Estradiol diphosphate
RN: 13445-48-2
UNII: 47022SBL14
InChIKey: KUTYECUKGBDMJH-ZBRFXRBCSA-N

Molecular Formula

  • C18-H26-O8-P2

Molecular Weight

  • 432.3434
 
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Names and Synonyms

Name of Substance

  • Estradiol diphosphate

Synonyms

  • Estra-1,3,5(10)-triene-3,17-diol (17beta)-, bis(dihydrogen phosphate)
  • Estradiol diphosphate
  • UNII-47022SBL14

Registry Numbers

CAS Registry Number

  • 13445-48-2

FDA UNII

  • 47022SBL14

System Generated Number

  • 0013445482

Structure Descriptors

InChI

1S/C18H26O8P2/c1-18-9-8-14-13-5-3-12(25-27(19,20)21)10-11(13)2-4-15(14)16(18)6-7-17(18)26-28(22,23)24/h3,5,10,14-17H,2,4,6-9H2,1H3,(H2,19,20,21)(H2,22,23,24)/t14-,15-,16+,17+,18+/m1/s1

InChIKey

KUTYECUKGBDMJH-ZBRFXRBCSA-N

Smiles

C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H]2OP(=O)(O)O)OP(=O)(O)O