![(2S)-1-[(2S,5S,7R,8R)-7-[(Z,1R)-1-hydroxy-6-(4-methoxybenzyl)oxy-hex-3-enyl]-8-methyl-1,6-dioxaspiro[4.5]decan-2-yl]hept-6-en-2-ol](/api/spectrum/1iIafSeE2q1/structure.png?h=300&w=458 "(2S)-1-[(2S,5S,7R,8R)-7-[(Z,1R)-1-hydroxy-6-(4-methoxybenzyl)oxy-hex-3-enyl]-8-methyl-1,6-dioxaspiro[4.5]decan-2-yl]hept-6-en-2-ol")
| SpectraBase Compound ID | B3frNlqa1E3 |
|---|---|
| InChI | InChI=1S/C30H46O6/c1-4-5-7-10-25(31)21-27-17-19-30(35-27)18-16-23(2)29(36-30)28(32)11-8-6-9-20-34-22-24-12-14-26(33-3)15-13-24/h4,6,8,12-15,23,25,27-29,31-32H,1,5,7,9-11,16-22H2,2-3H3/b8-6-/t23-,25+,27+,28-,29-,30+/m1/s1 |
| InChIKey | SHPAGPCOAYZHDL-IOLUCIPTSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C30H46O6 |
| Exact Mass | 502.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1iIafSeE2q1 |
|---|---|
| Name | (2S)-1-[(2S,5S,7R,8R)-7-[(Z,1R)-1-hydroxy-6-(4-methoxybenzyl)oxy-hex-3-enyl]-8-methyl-1,6-dioxaspiro[4.5]decan-2-yl]hept-6-en-2-ol |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O6 |
| InChI | InChI=1S/C30H46O6/c1-4-5-7-10-25(31)21-27-17-19-30(35-27)18-16-23(2)29(36-30)28(32)11-8-6-9-20-34-22-24-12-14-26(33-3)15-13-24/h4,6,8,12-15,23,25,27-29,31-32H,1,5,7,9-11,16-22H2,2-3H3/b8-6-/t23-,25+,27+,28-,29-,30+/m1/s1 |
| InChIKey | SHPAGPCOAYZHDL-IOLUCIPTSA-N |
| Literature Reference Author | P.V.D.WEGHE,D.AOUN,J.G.BOITEAU,J.EUSTACHE |
| Literature Reference Citation | ORG.LETTERS,4,4105(2002) |
| Literature Reference DOI | 10.1021/ol0268438 |
| Molecular Weight | 502.692 g/mol |
| Sample ID | 33523 |
| Solvent | CDCl3 |