SpectraBase Compound ID | Dy72IboTzM3 |
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InChI | InChI=1S/C37H50N2O10/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3/t19?,21-,22?,24+,25-,27?,28+,29?,30+,33?,34+,35-,36+,37-/m1/s1 |
InChIKey | XLTANAWLDBYGFU-ICBGLTLBSA-N |
Mol Weight | 682.8 g/mol |
Molecular Formula | C37H50N2O10 |
Exact Mass | 682.346546 g/mol |
SpectraBase Spectrum ID | 26288cD2MUu |
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Name | METHYL-LYCACONITINE |
Compound Number | 17 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H50N2O10 |
InChI | InChI=1S/C37H50N2O10/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3/t19?,21-,22?,24+,25-,27?,28+,29?,30+,33?,34+,35-,36+,37-/m1/s1 |
InChIKey | XLTANAWLDBYGFU-ICBGLTLBSA-N |
Literature Reference Author | S.W.PELLETIER,N.V.MODY,R.S.SAWHNEY,J.BHATTACHARYYA |
Literature Reference Citation | HETEROCYCLES,7,327(1977) |
Literature Reference DOI | 10.3987/S-1977-01-0327 |
Molecular Weight | 682.811 g/mol |
Solvent | CDCl3 |
Source File Reference | UWRK2464 |