| SpectraBase Compound ID | 4BqOCQjExsK |
|---|---|
| InChI | InChI=1S/C28H38O9/c1-8-9-22(31)36-20-13-14(2)12-19-23(16(4)27(33)37-19)25(32)24-15(3)10-11-21(34-17(5)29)28(24,7)26(20)35-18(6)30/h10,12,19-21,24-26,32H,8-9,11,13H2,1-7H3/b14-12-/t19-,20-,21-,24+,25+,26-,28-/m0/s1 |
| InChIKey | XZZGFTXDMFRZDT-ZBDDJRLTSA-N |
| Mol Weight | 518.6 g/mol |
| Molecular Formula | C28H38O9 |
| Exact Mass | 518.251583 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 15H67fYBUYn |
|---|---|
| Name | EXCAVATOID-E |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O9 |
| InChI | InChI=1S/C28H38O9/c1-8-9-22(31)36-20-13-14(2)12-19-23(16(4)27(33)37-19)25(32)24-15(3)10-11-21(34-17(5)29)28(24,7)26(20)35-18(6)30/h10,12,19-21,24-26,32H,8-9,11,13H2,1-7H3/b14-12-/t19-,20-,21-,24+,25+,26-,28-/m0/s1 |
| InChIKey | XZZGFTXDMFRZDT-ZBDDJRLTSA-N |
| Literature Reference Author | P.J.SUNG,B.Y.CHEN,M.R.LIN,T.L.HWANG,W.H.WANG,J.H.SHEU,Y.C.WU |
| Literature Reference Citation | MAR.DRUGS,7,472(2009) |
| Literature Reference DOI | 10.3390/md7030472 |
| Molecular Weight | 518.604 g/mol |
| Source File Reference | UWIR6316 |