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Substance Name: 8,9-Dehydroestrone sodium sulfate
RN: 61612-83-7
UNII: B825F101CJ
InChIKey: LLUMKBPKZHXWDL-AKXYIILFSA-M

Molecular Formula

  • C18-H19-O5-S.Na

Molecular Weight

  • 370.3991
 
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Names and Synonyms

Name of Substance

  • 8,9-Dehydroestrone sodium sulfate

Synonym

  • UNII-B825F101CJ

Registry Numbers

CAS Registry Number

  • 61612-83-7

FDA UNII

  • B825F101CJ

System Generated Number

  • 0061612837

Structure Descriptors

InChI

1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3,5,10,16H,2,4,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t16-,18-;/m0./s1

InChIKey

LLUMKBPKZHXWDL-AKXYIILFSA-M

Smiles

C[C@]12CCC3=C([C@@H]1CCC2=O)CCc4c3ccc(c4)OS(=O)(=O)[O-].[Na+]