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Substance Name: Thalmirabine
RN: 75352-27-1
InChIKey: CLAUJNOKVABGOJ-UHFFFAOYSA-N

Molecular Formula

  • C39-H44-N2-O8

Molecular Weight

  • 668.7826
 
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Names and Synonyms

Results Name

  • Thalmirabine

Synonym

  • Thalmirabine

Systematic Name

  • 4H-2,3,7-(1,3)Butadien(1)yl(4)ylidene-15,18-etheno-9,13-metheno-19H-pyrido(2,3,4-tu)-1,14,6-benzodioxaazacyclodocosin-23-ol,5,6,7,8,19a,20,21,22-octahydro-12,24,25,31,32-pentamethoxy-6,20-dimethyl-, (7S,19aS)-

Registry Numbers

CAS Registry Number

  • 75352-27-1

System Generated Number

  • 0075352271

Structure Descriptors

InChI

1S/C39H44N2O8/c1-40-16-14-25-27-21-32(44-4)36(45-5)35(25)49-37-33-26(34(42)38(46-6)39(37)47-7)15-17-41(2)29(33)18-22-8-11-24(12-9-22)48-31-20-23(19-28(27)40)10-13-30(31)43-3/h8-13,20-21,28-29,42H,14-19H2,1-7H3

InChIKey

CLAUJNOKVABGOJ-UHFFFAOYSA-N

Smiles

COc1ccc2CC3N(C)CCc4c(Oc5c(OC)c(OC)c(O)c6CCN(C)C(Cc7ccc(Oc1c2)cc7)c56)c(OC)c(OC)cc34