| SpectraBase Compound ID | EBKg9TgAg4U |
|---|---|
| InChI | InChI=1S/C27H42O5/c1-16(28)32-15-27-12-9-18-24(2,3)10-6-11-25(18,4)20(27)13-21(29)26(5)19(27)8-7-17-14-31-23(30)22(17)26/h7,18-23,29-30H,6,8-15H2,1-5H3/t18-,19+,20+,21+,22+,23+,25-,26+,27+/m0/s1 |
| InChIKey | JEKWLYYGSPKXIZ-FVIMVWJTSA-N |
| Mol Weight | 446.6 g/mol |
| Molecular Formula | C27H42O5 |
| Exact Mass | 446.303224 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48XjjZKW6LP |
|---|---|
| Name | 24-ACETOXY-12-DEACETYL-12-EPI-DEOXOSCALARIN |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O5 |
| InChI | InChI=1S/C27H42O5/c1-16(28)32-15-27-12-9-18-24(2,3)10-6-11-25(18,4)20(27)13-21(29)26(5)19(27)8-7-17-14-31-23(30)22(17)26/h7,18-23,29-30H,6,8-15H2,1-5H3/t18-,19+,20+,21+,22+,23+,25-,26+,27+/m0/s1 |
| InChIKey | JEKWLYYGSPKXIZ-FVIMVWJTSA-N |
| Literature Reference Author | P.KARUSO,R.C.CAMBIE,B.F.BOWDEN,P.R.BERGQUIST |
| Literature Reference Citation | J.NAT.PROD.,52,289(1989) |
| Literature Reference DOI | 10.1021/np50062a012 |
| Molecular Weight | 446.627 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1139 |