| SpectraBase Compound ID | Ij1A1VuBWcZ |
|---|---|
| InChI | InChI=1S/C35H51NO9/c1-8-36-18-32(19-39-3)15-14-23(41-5)35-22-16-33(38)24(42-6)17-34(44-9-2,26(29(35)36)27(43-7)28(32)35)25(22)30(33)45-31(37)20-10-12-21(40-4)13-11-20/h10-13,22-30,38H,8-9,14-19H2,1-7H3/t22-,23+,24+,25-,26?,27+,28-,29?,30-,32+,33+,34-,35+/m1/s1 |
| InChIKey | AXNQMSNNMRVXNS-VZUXAYQKSA-N |
| Mol Weight | 629.8 g/mol |
| Molecular Formula | C35H51NO9 |
| Exact Mass | 629.356382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GLhovdzbjll |
|---|---|
| Name | ACOFORESTINE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H51NO9 |
| InChI | InChI=1S/C35H51NO9/c1-8-36-18-32(19-39-3)15-14-23(41-5)35-22-16-33(38)24(42-6)17-34(44-9-2,26(29(35)36)27(43-7)28(32)35)25(22)30(33)45-31(37)20-10-12-21(40-4)13-11-20/h10-13,22-30,38H,8-9,14-19H2,1-7H3/t22-,23+,24+,25-,26?,27+,28-,29?,30-,32+,33+,34-,35+/m1/s1 |
| InChIKey | AXNQMSNNMRVXNS-VZUXAYQKSA-N |
| Literature Reference Author | S.W.PELLETIER,B.S.JOSHI,J.A.GLINSKI,H.P.CHOKSHI,S.CHEN,K.BHA NDARY,K.GO |
| Literature Reference Citation | HETEROCYCLES,25,365(1987) |
| Literature Reference DOI | 10.3987/S-1987-01-0365 |
| Molecular Weight | 629.791 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED5278 |