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Substance Name: 14-Ketoalstonidine
RN: 111509-15-0
InChIKey: AHSFOHHJGMBTNA-QITLCBANSA-N

Molecular Formula

  • C22-H22-N2-O5

Molecular Weight

  • 394.425
 
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Names and Synonyms

Results Name

  • 14-Ketoalstonidine

Synonym

  • 14-Ketoalstonidine

Systematic Name

  • 2H-Pyran-5-carboxylic acid, 3,4-dihydro-3-(hydroxymethyl)-2-methyl-4-((9-methyl-9H-pyrido(3,4-b)indol-1-yl)carbonyl)-, methyl ester, (2S-(2alpha,3beta,4beta))-

Registry Numbers

CAS Registry Number

  • 111509-15-0

System Generated Number

  • 0111509150

Structure Descriptors

InChI

1S/C22H22N2O5/c1-12-15(10-25)18(16(11-29-12)22(27)28-3)21(26)19-20-14(8-9-23-19)13-6-4-5-7-17(13)24(20)2/h4-9,11-12,15,18,25H,10H2,1-3H3/t12-,15-,18-/m0/s1

InChIKey

AHSFOHHJGMBTNA-QITLCBANSA-N

Smiles

C=1([C@H]([C@H]([C@@H](OC1)C)CO)C(=O)c1nccc2c1n(c1ccccc21)C)C(=O)OC