| SpectraBase Compound ID | 3tsdf3SWma |
|---|---|
| InChI | InChI=1S/C32H46O10/c1-15-24(35)26(37-5)27(40-16(2)33)29(39-15)41-19-8-10-30(3)18(13-19)6-7-21-23(30)25-28(42-25)31(4)20(9-11-32(21,31)36)17-12-22(34)38-14-17/h12,15,18-21,23-29,35-36H,6-11,13-14H2,1-5H3/t15-,18+,19-,20+,21+,23+,24-,25+,26+,27+,28+,29+,30-,31-,32-/m0/s1 |
| InChIKey | IFNWZFVEJHHHIZ-FRNALKNISA-N |
| Mol Weight | 590.7 g/mol |
| Molecular Formula | C32H46O10 |
| Exact Mass | 590.309098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3y7KXUaqDsP |
|---|---|
| Name | CERBERTIN,(3-BETA-O-ALPHA-L-2'-OAC-THEVETOSID,5-BETA-H,11-ALPHA,12-ALPHA-EPOXY) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H46O10 |
| InChI | InChI=1S/C32H46O10/c1-15-24(35)26(37-5)27(40-16(2)33)29(39-15)41-19-8-10-30(3)18(13-19)6-7-21-23(30)25-28(42-25)31(4)20(9-11-32(21,31)36)17-12-22(34)38-14-17/h12,15,18-21,23-29,35-36H,6-11,13-14H2,1-5H3/t15-,18+,19-,20+,21+,23+,24-,25+,26+,27+,28+,29+,30-,31-,32-/m0/s1 |
| InChIKey | IFNWZFVEJHHHIZ-FRNALKNISA-N |
| Literature Reference Author | L.BROWN,H.T.A.CHEUNG,R.THOMAS,T.R.WATSON,J.L.E.NEMORIN |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1779(1981) |
| Literature Reference DOI | 10.1039/p19810001779 |
| Molecular Weight | 590.711 g/mol |
| Solvent | CDCl3:DMSO |
| Source File Reference | UNIW8522 |