![#1;NUDIFLOSIDE-D;5-ETHYLIDENE-4-[3-HYDROXY-2-(2-HYDROXY-1-METHYL-ETHYL)-5-METHYL-CYCLOPENTYLMETHOXYCARBONYLMETHYL]-6-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-TETRAHYD](/api/spectrum/36MbmD92Rgp/structure.png?h=300&w=458 "#1;NUDIFLOSIDE-D;5-ETHYLIDENE-4-[3-HYDROXY-2-(2-HYDROXY-1-METHYL-ETHYL)-5-METHYL-CYCLOPENTYLMETHOXYCARBONYLMETHYL]-6-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-TETRAHYD")
| SpectraBase Compound ID | CLKm32Ktcfx |
|---|---|
| InChI | InChI=1S/C27H42O13/c1-5-14-15(7-20(31)37-10-16-12(2)6-18(30)21(16)13(3)8-28)17(25(35)36-4)11-38-26(14)40-27-24(34)23(33)22(32)19(9-29)39-27/h5,11-13,15-16,18-19,21-24,26-30,32-34H,6-10H2,1-4H3/b14-5-/t12-,13+,15-,16+,18-,19+,21-,22+,23-,24+,26-,27-/m0/s1 |
| InChIKey | HMVRPFGHXCDNLO-PQUOJQDLSA-N |
| Mol Weight | 574.6 g/mol |
| Molecular Formula | C27H42O13 |
| Exact Mass | 574.262541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 36MbmD92Rgp |
|---|---|
| Name | #1;NUDIFLOSIDE-D;5-ETHYLIDENE-4-[3-HYDROXY-2-(2-HYDROXY-1-METHYL-ETHYL)-5-METHYL-CYCLOPENTYLMETHOXYCARBONYLMETHYL]-6-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-TETRAHYD |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O13 |
| InChI | InChI=1S/C27H42O13/c1-5-14-15(7-20(31)37-10-16-12(2)6-18(30)21(16)13(3)8-28)17(25(35)36-4)11-38-26(14)40-27-24(34)23(33)22(32)19(9-29)39-27/h5,11-13,15-16,18-19,21-24,26-30,32-34H,6-10H2,1-4H3/b14-5-/t12-,13+,15-,16+,18-,19+,21-,22+,23-,24+,26-,27-/m0/s1 |
| InChIKey | HMVRPFGHXCDNLO-PQUOJQDLSA-N |
| Literature Reference Author | S.HANESSIAN,E.MAINETTI,F.LECOMTE |
| Literature Reference Citation | ORG.LETTERS,8,4047(2006) |
| Literature Reference DOI | 10.1021/ol0615230 |
| Molecular Weight | 574.623 g/mol |
| Sample ID | 59789 |
| Solvent | CD3OD |