| SpectraBase Compound ID | Bihzkn2IdLX |
|---|---|
| InChI | InChI=1S/C26H34O7/c1-14(27)30-15-4-8-22(2)16-5-9-23(3)18(25-11-7-20(28)31-21(25)33-25)12-19-26(23,32-19)17(16)6-10-24(22,29)13-15/h7,11,15-19,21,29H,4-6,8-10,12-13H2,1-3H3/t15-,16-,17+,18-,19+,21-,22+,23+,24-,25+,26+/m0/s1 |
| InChIKey | OLNUMGINZOEDOM-TUNRYRPVSA-N |
| Mol Weight | 458.6 g/mol |
| Molecular Formula | C26H34O7 |
| Exact Mass | 458.230453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1vI7NVvXNVX |
|---|---|
| Name | 3-BETA-ACETOXY-(20S,21R)-EPOXY-MARINOBUFAGIN |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H34O7 |
| InChI | InChI=1S/C26H34O7/c1-14(27)30-15-4-8-22(2)16-5-9-23(3)18(25-11-7-20(28)31-21(25)33-25)12-19-26(23,32-19)17(16)6-10-24(22,29)13-15/h7,11,15-19,21,29H,4-6,8-10,12-13H2,1-3H3/t15-,16-,17+,18-,19+,21-,22+,23+,24-,25+,26+/m0/s1 |
| InChIKey | OLNUMGINZOEDOM-TUNRYRPVSA-N |
| Literature Reference Author | G.A.CUNHA-FILHO,I.S.RESCK,B.C.CAVALCANTI,C.O.PESSOA,M.O.MORA ES,J.R.O.FERREIRA |
| Literature Reference Citation | TOXICON,56,339(2010) |
| Literature Reference DOI | 10.1016/j.toxicon.2010.03.021 |
| Molecular Weight | 458.552 g/mol |
| Source File Reference | UWIR6473 |