| SpectraBase Compound ID | 1CNEZijZAPO |
|---|---|
| InChI | InChI=1S/C28H36O10/c1-14(29)36-19-11-20(31)35-13-27(19)16-6-8-25(4)21(15-7-9-34-12-15)37-23(32)22-28(25,38-22)26(16,5)18(30)10-17(27)24(2,3)33/h7,9,12,16-19,21-22,30,33H,6,8,10-11,13H2,1-5H3/t16-,17-,18+,19-,21-,22+,25-,26-,27+,28+/m0/s1 |
| InChIKey | LVLWRZVQBWKGSH-ZORUZYPSSA-N |
| Mol Weight | 532.6 g/mol |
| Molecular Formula | C28H36O10 |
| Exact Mass | 532.230847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6HpzcwmTuz0 |
|---|---|
| Name | (1S*)-ACETOXY-(7R*)-HYDROXY-7-DEOXO-ICHANGIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O10 |
| InChI | InChI=1S/C28H36O10/c1-14(29)36-19-11-20(31)35-13-27(19)16-6-8-25(4)21(15-7-9-34-12-15)37-23(32)22-28(25,38-22)26(16,5)18(30)10-17(27)24(2,3)33/h7,9,12,16-19,21-22,30,33H,6,8,10-11,13H2,1-5H3/t16-,17-,18+,19-,21-,22+,25-,26-,27+,28+/m0/s1 |
| InChIKey | LVLWRZVQBWKGSH-ZORUZYPSSA-N |
| Literature Reference Author | V.G.P.SEVERINO,S.D.L.D.FREITAS,P.A.C.BRAGA,M.R.FORIM,M.F.D.G .F.D.SILVA,J.B.FERNA |
| Literature Reference Citation | MOLECULES,19,12031(2014) |
| Literature Reference DOI | 10.3390/molecules190812031 |
| Molecular Weight | 532.588 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR15063 |