| SpectraBase Compound ID | 9jyAkeOeaiv |
|---|---|
| InChI | InChI=1S/C34H46O15/c1-15-23(43-16(2)35)13-34(49-22(8)41)30(47-20(6)39)28-32(11,24(44-17(3)36)12-25-33(28,14-42-25)48-21(7)40)29(46-19(5)38)27(45-18(4)37)26(15)31(34,9)10/h23-25,27-30H,12-14H2,1-11H3/t23-,24-,25+,27?,28-,29-,30-,32+,33-,34+/m0/s1 |
| InChIKey | XLKZXPVMSVAIHO-IUEOEINUSA-N |
| Mol Weight | 694.7 g/mol |
| Molecular Formula | C34H46O15 |
| Exact Mass | 694.283671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1DptjDmgjuN |
|---|---|
| Name | 1-ACETYLBACCATIN-IV |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46O15 |
| InChI | InChI=1S/C34H46O15/c1-15-23(43-16(2)35)13-34(49-22(8)41)30(47-20(6)39)28-32(11,24(44-17(3)36)12-25-33(28,14-42-25)48-21(7)40)29(46-19(5)38)27(45-18(4)37)26(15)31(34,9)10/h23-25,27-30H,12-14H2,1-11H3/t23-,24-,25+,27?,28-,29-,30-,32+,33-,34+/m0/s1 |
| InChIKey | XLKZXPVMSVAIHO-IUEOEINUSA-N |
| Literature Reference Author | Z.ZHANG,Z.JIA |
| Literature Reference Citation | PHYTOCHEM.,29,3673(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85303-W |
| Molecular Weight | 694.730 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26957 |