| SpectraBase Compound ID | GkpSVHCA2Fx |
|---|---|
| InChI | InChI=1S/C30H40N2O9/c1-37-18-12-28(35)20-16(11-15(18)21(20)39-3)29-19(38-2)9-10-27(13-41-24(33)14-7-5-6-8-17(14)31)22(29)23(40-4)30(28,36)25(29)32-26(27)34/h5-8,15-16,18-23,25,35-36H,9-13,31H2,1-4H3,(H,32,34)/t15-,16-,18+,19+,20-,21+,22-,23+,25+,27+,28-,29+,30+/m1/s1 |
| InChIKey | PNGXSCHADQAXDZ-ZJSPXHCSSA-N |
| Mol Weight | 572.7 g/mol |
| Molecular Formula | C30H40N2O9 |
| Exact Mass | 572.273381 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1lvA56IC9xv |
|---|---|
| Name | PACIFININE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40N2O9 |
| InChI | InChI=1S/C30H40N2O9/c1-37-18-12-28(35)20-16(11-15(18)21(20)39-3)29-19(38-2)9-10-27(13-41-24(33)14-7-5-6-8-17(14)31)22(29)23(40-4)30(28,36)25(29)32-26(27)34/h5-8,15-16,18-23,25,35-36H,9-13,31H2,1-4H3,(H,32,34)/t15-,16-,18+,19+,20-,21+,22-,23+,25+,27+,28-,29+,30+/m1/s1 |
| InChIKey | PNGXSCHADQAXDZ-ZJSPXHCSSA-N |
| Literature Reference Author | K.WADA,T.YAMAMOTO,H.BANDO,N.KAWAHARA |
| Literature Reference Citation | PHYTOCHEM.,31,2135(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80380-W |
| Molecular Weight | 572.656 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN6149 |