![(5S)-3-[(13R)-13-hydroxy-13-[(2R,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-5-methyl-5H-furan-2-one](/api/spectrum/ERHc9vUMdgr/structure.png?h=300&w=458 "(5S)-3-[(13R)-13-hydroxy-13-[(2R,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-5-methyl-5H-furan-2-one")
| SpectraBase Compound ID | 9eg16k9QSp6 |
|---|---|
| InChI | InChI=1S/C35H64O5/c1-3-4-5-6-7-8-12-15-18-21-24-31(36)33-26-27-34(40-33)32(37)25-22-19-16-13-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3/t29-,31-,32+,33-,34+/m0/s1 |
| InChIKey | RBSBTRALZZSVBA-DIPXFSDISA-N |
| Mol Weight | 564.9 g/mol |
| Molecular Formula | C35H64O5 |
| Exact Mass | 564.475375 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ERHc9vUMdgr |
|---|---|
| Name | (5S)-3-[(13R)-13-hydroxy-13-[(2R,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-5-methyl-5H-furan-2-one |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H64O5 |
| InChI | InChI=1S/C35H64O5/c1-3-4-5-6-7-8-12-15-18-21-24-31(36)33-26-27-34(40-33)32(37)25-22-19-16-13-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3/t29-,31-,32+,33-,34+/m0/s1 |
| InChIKey | RBSBTRALZZSVBA-DIPXFSDISA-N |
| Literature Reference Author | H.GOEKSEL,C.B.W.STARK |
| Literature Reference Citation | ORG.LETTERS,8,3433(2006) |
| Literature Reference DOI | 10.1021/ol060520k |
| Molecular Weight | 564.890 g/mol |
| Sample ID | 60644 |
| Solvent | CDCl3 |