| SpectraBase Compound ID | 2tLLLzs8qvE |
|---|---|
| InChI | InChI=1S/C43H60N2O9/c1-21-17-44(5)19-29-23(3)32(15-27(21)29)53-42(48)39-37(25-10-11-31(46)34(12-25)50-7)40(38(39)26-13-35(51-8)41(47)36(14-26)52-9)43(49)54-33-16-28-22(2)18-45(6)20-30(28)24(33)4/h10-14,21-24,27-30,32-33,37-40,46-47H,15-20H2,1-9H3/t21-,22+,23-,24+,27-,28+,29-,30+,32+,33-,37-,38-,39-,40-/m1/s1 |
| InChIKey | OXAKXFRIIVUHQU-CHTVCSDTSA-N |
| Mol Weight | 749.0 g/mol |
| Molecular Formula | C43H60N2O9 |
| Exact Mass | 748.429882 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5dgW8fjRqr0 |
|---|---|
| Name | METHOXY-INCARVILLATEINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H60N2O9 |
| InChI | InChI=1S/C43H60N2O9/c1-21-17-44(5)19-29-23(3)32(15-27(21)29)53-42(48)39-37(25-10-11-31(46)34(12-25)50-7)40(38(39)26-13-35(51-8)41(47)36(14-26)52-9)43(49)54-33-16-28-22(2)18-45(6)20-30(28)24(33)4/h10-14,21-24,27-30,32-33,37-40,46-47H,15-20H2,1-9H3/t21-,22+,23-,24+,27-,28+,29-,30+,32+,33-,37-,38-,39-,40-/m1/s1 |
| InChIKey | OXAKXFRIIVUHQU-CHTVCSDTSA-N |
| Literature Reference Author | Y.M.CHI,F.HASHIMOTO,W.M.YAN,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,46,763(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)89084-x |
| Molecular Weight | 748.957 g/mol |
| Sample ID | 44947 |
| Solvent | CDCl3 |