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Substance Name: 3-Dansylestrone
RN: 30804-69-4
InChIKey: FUQSZFCTVMQWSY-KCUJWJGTSA-N

Molecular Weight

  • 503.66
 
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Names and Synonyms

Name of Substance

  • 3-Dansylestrone

Synonym

  • Estrone-3-dansyl

Systematic Name

  • Estra-1,3,5(10)-trien-17-one, 3-(((5-(dimethylamino)-1-naphthalenyl)sulfonyl)oxy)-

Registry Numbers

CAS Registry Number

  • 30804-69-4

System Generated Number

  • 0030804694

Structure Descriptors

InChI

1S/C30H33NO4S/c1-30-17-16-22-21-13-11-20(18-19(21)10-12-23(22)26(30)14-15-29(30)32)35-36(33,34)28-9-5-6-24-25(28)7-4-8-27(24)31(2)3/h4-9,11,13,18,22-23,26H,10,12,14-17H2,1-3H3/t22-,23-,26+,30+/m1/s1

InChIKey

FUQSZFCTVMQWSY-KCUJWJGTSA-N

Smiles

c1(ccc2[C@H]3CC[C@@]4(C(CC[C@@H]4[C@@H]3CCc2c1)=O)C)OS(=O)(=O)c1cccc2c(cccc12)N(C)C