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Substance Name: 2,3,4-Trimethoxy-estra-1,3,5(10),8-tetraen-17-ol, sodium sulfate, (17beta)-(+/-)-
RN: 23257-47-8
UNII: YQZ6X9LS7J
InChIKey: XSXZXMBCJCZSKF-SMJUEESBSA-M

Molecular Weight

  • 446.4933
 
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Names and Synonyms

Name of Substance

  • 2,3,4-Trimethoxy-estra-1,3,5(10),8-tetraen-17-ol, sodium sulfate, (17beta)-(+/-)-

Synonyms

  • 2,3,4-Trimethoxy estr-1,3,5(10),8-tetraene-17betaol, hemisulfate ester, sodium salt, dl-
  • UNII-YQZ6X9LS7J

Registry Numbers

CAS Registry Number

  • 23257-47-8

FDA UNII

  • YQZ6X9LS7J

System Generated Number

  • 0023257478

Structure Descriptors

InChI

1S/C21H28O7S.Na/c1-21-10-9-12-13(16(21)7-8-18(21)28-29(22,23)24)5-6-14-15(12)11-17(25-2)20(27-4)19(14)26-3;/h11,16,18H,5-10H2,1-4H3,(H,22,23,24);/q;+1/p-1/t16-,18-,21-;/m0./s1

InChIKey

XSXZXMBCJCZSKF-SMJUEESBSA-M

Smiles

C[C@]12CCC3=C([C@@H]1CC[C@@H]2OS(=O)(=O)[O-])CCc4c3cc(c(c4OC)OC)OC.[Na+]