| SpectraBase Compound ID | 98eFNW0hiMl |
|---|---|
| InChI | InChI=1S/C43H68O12/c1-14-17-34-28(7)37(52-31(10)44)23-43(49,55-34)30(9)39(47)29(8)41-35(50-12)19-16-18-24(3)20-27(6)40(53-32(11)45)33(15-2)38(46)26(5)21-25(4)22-36(51-13)42(48)54-41/h14,16-19,21-22,26-30,33-35,37-41,46-47,49H,15,20,23H2,1-13H3/b17-14+,19-16-,24-18-,25-21-,36-22+/t26-,27-,28+,29+,30+,33-,34+,35+,37+,38-,39-,40-,41-,43+/m1/s1 |
| InChIKey | WLDPTYDCSZSPAO-KNMPWPMPSA-N |
| Mol Weight | 777.0 g/mol |
| Molecular Formula | C43H68O12 |
| Exact Mass | 776.471078 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 21ny174qQHi |
|---|---|
| Name | 9,23-DI-O-ACETYL-CONCANOLIDE-A |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O12 |
| InChI | InChI=1S/C43H68O12/c1-14-17-34-28(7)37(52-31(10)44)23-43(49,55-34)30(9)39(47)29(8)41-35(50-12)19-16-18-24(3)20-27(6)40(53-32(11)45)33(15-2)38(46)26(5)21-25(4)22-36(51-13)42(48)54-41/h14,16-19,21-22,26-30,33-35,37-41,46-47,49H,15,20,23H2,1-13H3/b17-14+,19-16-,24-18-,25-21-,36-22+/t26-,27-,28+,29+,30+,33-,34+,35+,37+,38-,39-,40-,41-,43+/m1/s1 |
| InChIKey | WLDPTYDCSZSPAO-KNMPWPMPSA-N |
| Literature Reference Author | K.U.BINDSEIL,A.ZEECK |
| Literature Reference Citation | J.ORG.CHEM.,58,5487(1993) |
| Literature Reference DOI | 10.1021/jo00072a036 |
| Molecular Weight | 777.006 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS19913 |