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Substance Name: 2,3,4-Trimethoxy-estra-1,3,5(10),8-tetraen-17-ol, hydrogen sulfate, (17beta)-(+/-)-
RN: 47620-70-2
UNII: NR80M0W0GK
InChIKey: JMZGMDPXMHHCGP-MDKPJZGXSA-N

Molecular Weight

  • 424.5112
 
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Names and Synonyms

Name of Substance

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

Synonyms

  • Estra-1,3,5(10),8-tetraen-17-ol, 2,3,4-trimethoxy-, hydrogen sulfate, (17beta)-(+/-)-
  • UNII-NR80M0W0GK

Registry Numbers

CAS Registry Number

  • 47620-70-2

FDA UNII

  • NR80M0W0GK

System Generated Number

  • 0047620702

Structure Descriptors

InChI

1S/C21H28O7S/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)/t16-,18-,21-/m0/s1

InChIKey

JMZGMDPXMHHCGP-MDKPJZGXSA-N

Smiles

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