| SpectraBase Compound ID | BzAqc6y4dyF |
|---|---|
| InChI | InChI=1S/C28H40O12/c1-12-17(37-13(2)29)10-28(35)24(40-16(5)32)22-26(8,18(33)9-19(38-14(3)30)27(22)11-36-27)23(34)21(39-15(4)31)20(12)25(28,6)7/h17-19,21-24,33-35H,9-11H2,1-8H3/t17-,18-,19-,21+,22?,23-,24-,26+,27+,28+/m0/s1 |
| InChIKey | WJMBBODKITXTJA-XXKTVBPCSA-N |
| Mol Weight | 568.6 g/mol |
| Molecular Formula | C28H40O12 |
| Exact Mass | 568.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BlihZSZkIMF |
|---|---|
| Name | TAXUMAIROL-B;2-ALPHA,5-ALPHA,10-BETA,13-ALPHA-TETRAACETOXY-1-BETA,7-BETA,9-ALPHA-TRIHYDROXY-4-BETA,20-EPOXYTAX-11-ENE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O12 |
| InChI | InChI=1S/C28H40O12/c1-12-17(37-13(2)29)10-28(35)24(40-16(5)32)22-26(8,18(33)9-19(38-14(3)30)27(22)11-36-27)23(34)21(39-15(4)31)20(12)25(28,6)7/h17-19,21-24,33-35H,9-11H2,1-8H3/t17-,18-,19-,21+,22?,23-,24-,26+,27+,28+/m0/s1 |
| InChIKey | WJMBBODKITXTJA-XXKTVBPCSA-N |
| Literature Reference Author | Y.C.SHEN,C.Y.CHEN |
| Literature Reference Citation | PHYTOCHEM.,44,1527(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00748-0 |
| Molecular Weight | 568.618 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWAN93 |