| SpectraBase Compound ID | 50U9hSFe01a |
|---|---|
| InChI | InChI=1S/C29H40N2O6/c1-3-31-13-27(14-37-26(34)15-6-4-5-7-19(15)30)9-8-22(32)29-17-10-16-20(36-2)12-28(35,23(17)24(16)33)18(25(29)31)11-21(27)29/h4-7,16-18,20-25,32-33,35H,3,8-14,30H2,1-2H3/t16-,17?,18+,20+,21-,22+,23?,24+,25?,27+,28+,29-/m1/s1 |
| InChIKey | LFVBURMQWGSBOW-DVFSIFQRSA-N |
| Mol Weight | 512.6 g/mol |
| Molecular Formula | C29H40N2O6 |
| Exact Mass | 512.288637 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BKM7kboEePf |
|---|---|
| Name | ACOSEPTRIDININE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H40N2O6 |
| InChI | InChI=1S/C29H40N2O6/c1-3-31-13-27(14-37-26(34)15-6-4-5-7-19(15)30)9-8-22(32)29-17-10-16-20(36-2)12-28(35,23(17)24(16)33)18(25(29)31)11-21(27)29/h4-7,16-18,20-25,32-33,35H,3,8-14,30H2,1-2H3/t16-,17?,18+,20+,21-,22+,23?,24+,25?,27+,28+,29-/m1/s1 |
| InChIKey | LFVBURMQWGSBOW-DVFSIFQRSA-N |
| Literature Reference Author | H.M.SAYED,H.K.DESAI,S.A.ROSS,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,55,1595(1992) |
| Literature Reference DOI | 10.1021/np50089a006 |
| Molecular Weight | 512.646 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS4273 |