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Substance Name: Thaliadanine
RN: 31199-54-9
InChIKey: HSYATSIKOGRUDZ-VMPREFPWSA-N

Molecular Formula

  • C41-H48-N2-O9

Molecular Weight

  • 712.835
 
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Names and Synonyms

Results Name

  • Thaliadanine

Synonyms

  • O-Demethyladiantifoline
  • Thaliadanine

Systematic Name

  • Codamine, 6'-((1,2,3,10-tetramethoxy-6aalpha-aporphin-9-yl)oxy)-

Registry Numbers

CAS Registry Number

  • 31199-54-9

System Generated Number

  • 0031199549

Structure Descriptors

InChI

1S/C41H48N2O9/c1-42-12-10-22-16-32(45-3)30(44)19-26(22)28(42)15-24-18-33(46-4)35(48-6)21-31(24)52-36-17-23-14-29-37-25(11-13-43(29)2)39(49-7)41(51-9)40(50-8)38(37)27(23)20-34(36)47-5/h16-21,28-29,44H,10-15H2,1-9H3/t28-,29-/m0/s1

InChIKey

HSYATSIKOGRUDZ-VMPREFPWSA-N

Smiles

C1[N@@]([C@H](c2cc(c(cc2C1)OC)O)Cc1c(cc(c(c1)OC)OC)Oc1cc2c(c3c4c(CC[N@@]([C@@H]4C2)C)c(c(c3OC)OC)OC)cc1OC)C