SpectraBase Spectrum ID |
C491YrnXLY1 |
Name |
1H-Cyclopent[cd]indole-5-carboxylic acid, decahydro-1,7b-dimethyl-6-(1-methylethyl)-7-oxo-, methyl ester, (2a.alpha.,4a.alpha.,5.beta.,6.alpha.,7a.alpha.,7b.alpha.)-(.+-.)- |
CAS Registry Number |
53403-50-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H27NO3 |
InChI |
InChI=1S/C17H27NO3/c1-9(2)12-13(16(20)21-5)11-7-6-10-8-18(4)15(14(12)19)17(10,11)3/h9-13,15H,6-8H2,1-5H3/t10-,11+,12+,13-,15-,17+/m0/s1 |
InChIKey |
CBDAOVWBKMOXIU-CWDSLDSZSA-N |
Molecular Weight |
293.407 g/mol |
SMILES |
[C@]12([C@@]3(C(=O)[C@@]([C@]([C@]2(CC[C@]1(CN3C)[H])[H])(C(=O)OC)[H])(C(C)C)[H])[H])C |
SPLASH |
splash10-0aor-0590000000-4dd89755a3ed6a05856b |
Source of Spectrum |
C-102-1403-0 |
Synonyms |
Methyl (2aR,4aR,5S,6R,7aR,7bS)-6-isopropyl-1,7b-dimethyl-7-oxodecahydro-1H-cyclopenta[cd]indole-5-carboxylate
Methyl ester of N-methyl-11.alpha.-methyl-7-keto-6.alpha.-(2-propyl)-2,3,4,5,6,8.alpha.,9.alpha.,10.alpha.-octahydrocyclopenteno[cd]indole-5.beta.-carboxylic acid
Methyl ketodendrobinate |
Wiley ID |
1296399 |