| SpectraBase Compound ID | AKP8w6E7sMH |
|---|---|
| InChI | InChI=1S/C24H38O8/c1-12(2)19-16(27)11-24(7,31-15(5)26)21-18-10-13(3)17(32-28)8-9-23(6,30-14(4)25)22(29-18)20(19)21/h12,16-22,27-28H,3,8-11H2,1-2,4-7H3/t16-,17+,18-,19+,20-,21-,22-,23-,24-/m1/s1 |
| InChIKey | SUFJATWTWJPTJA-HKCXSXPBSA-N |
| Mol Weight | 454.6 g/mol |
| Molecular Formula | C24H38O8 |
| Exact Mass | 454.256668 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 | 48gzagT3urc |
|---|---|
| Name | SIMPLEXIN-R |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H38O8 |
| InChI | InChI=1S/C24H38O8/c1-12(2)19-16(27)11-24(7,31-15(5)26)21-18-10-13(3)17(32-28)8-9-23(6,30-14(4)25)22(29-18)20(19)21/h12,16-22,27-28H,3,8-11H2,1-2,4-7H3/t16-,17+,18-,19+,20-,21-,22-,23-,24-/m1/s1 |
| InChIKey | SUFJATWTWJPTJA-HKCXSXPBSA-N |
| Literature Reference Author | S.L.WU,J.H.SU,C.Y.HUANG,C.J.TAI,P.J.SUNG,C.C.LIAW,J.H.SHEU |
| Literature Reference Citation | MAR.DRUGS,10,1203(2012) |
| Literature Reference DOI | 10.3390/md10061203 |
| Molecular Weight | 454.561 g/mol |
| Source File Reference | UWIR5825 |