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Substance Name: 2,4-Dideuterioestradiol
RN: 53866-33-4
InChIKey: VOXZDWNPVJITMN-JXCLBMSPSA-N

Classification Codes

  • Hormone
  • Tumor Data

Molecular Formula

  • C18-H22-D2-O2

Molecular Weight

  • 274.398
 
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Names and Synonyms

Results Name

  • 2,4-Dideuterioestradiol

Synonym

  • 2,4-Dideuterioestradiol

Systematic Name

  • Estra-1,3,5(10)-triene-2,4-D2-3,17-diol, (17-beta)-

Registry Numbers

CAS Registry Number

  • 53866-33-4

System Generated Number

  • 0053866334

Structure Descriptors

InChI

1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1/i3D,10D

InChIKey

VOXZDWNPVJITMN-JXCLBMSPSA-N

Smiles

[2H]c1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2c([2H])c1O