| SpectraBase Compound ID | CkSUAhP62lr |
|---|---|
| InChI | InChI=1S/C35H44O9/c1-19-26-16-25-17-27(39)20(2)31(34(25,6)7)32(42-22(4)37)33(43-23(5)38)35(26,8)29(41-21(3)36)18-28(19)44-30(40)15-14-24-12-10-9-11-13-24/h9-15,25-29,32-33,39H,1,16-18H2,2-8H3/b15-14+/t25-,26?,27+,28+,29+,32-,33+,35+/m1/s1 |
| InChIKey | SOSLCGUOOOQMEN-MIKUKUOZSA-N |
| Mol Weight | 608.7 g/mol |
| Molecular Formula | C35H44O9 |
| Exact Mass | 608.298533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XIWfXiwrJ0 |
|---|---|
| Name | 13-DEACETYL-2-DEACETOXYTAXININE-J |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44O9 |
| InChI | InChI=1S/C35H44O9/c1-19-26-16-25-17-27(39)20(2)31(34(25,6)7)32(42-22(4)37)33(43-23(5)38)35(26,8)29(41-21(3)36)18-28(19)44-30(40)15-14-24-12-10-9-11-13-24/h9-15,25-29,32-33,39H,1,16-18H2,2-8H3/b15-14+/t25-,26?,27+,28+,29+,32-,33+,35+/m1/s1 |
| InChIKey | SOSLCGUOOOQMEN-MIKUKUOZSA-N |
| Literature Reference Author | D.A.SUN,F.SAURIOL,O.MAMER,L.O.ZAMIR |
| Literature Reference Citation | CAN.J.CHEM.,79,1381(2001) |
| Literature Reference DOI | 10.1139/cjc-79-9-1381 |
| Molecular Weight | 608.729 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI16203 |