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Substance Name: 1-(Psoralen-8-oxyhexyl)thymine
RN: 78497-54-8
InChIKey: ZASJXZXSIHVXBV-UHFFFAOYSA-N

Molecular Formula

  • C22-H22-N2-O6

Molecular Weight

  • 410.424
 
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Names and Synonyms

Results Name

  • 1-(Psoralen-8-oxyhexyl)thymine

Synonyms

  • 1-(Psoralen-8-oxyhexyl)thymine
  • 5-Methyl-1-(6-((7-oxo-7H-furo(3,2-g)(1)benzopyran-9-yl)oxy)hexyl)-2,4(1H,3H)-pyrimidinedione
  • NSC 369881

Systematic Name

  • 2,4(1H,3H)-Pyrimidinedione, 5-methyl-1-(6-((7-oxo-7H-furo(3,2-g)(1)benzopyran-9-yl)oxy)hexyl)-

Registry Numbers

CAS Registry Number

  • 78497-54-8

System Generated Number

  • 0078497548

Structure Descriptors

InChI

1S/C22H22N2O6/c1-14-13-24(22(27)23-21(14)26)9-4-2-3-5-10-28-20-18-16(8-11-29-18)12-15-6-7-17(25)30-19(15)20/h6-8,11-13H,2-5,9-10H2,1H3,(H,23,26,27)

InChIKey

ZASJXZXSIHVXBV-UHFFFAOYSA-N

Smiles

[nH]1c(n(CCCCCCOc2c3oc(=O)ccc3cc3c2occ3)cc(c1=O)C)=O