![METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-6,8-O-ISOPROPYLIDENE-1-UNDECENYL]-6-METHOXYBENZOATE](/api/spectrum/Eh15ehg2bMg/structure.png?h=300&w=458 "METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-6,8-O-ISOPROPYLIDENE-1-UNDECENYL]-6-METHOXYBENZOATE")
| SpectraBase Compound ID | 1gkvuUL2HjE |
|---|---|
| InChI | InChI=1S/C30H40O6/c1-30(2)35-25(21-26(36-30)18-12-20-34-22-23-13-7-5-8-14-23)17-10-6-9-15-24-16-11-19-27(32-3)28(24)29(31)33-4/h5,7-9,11,13-16,19,25-26H,6,10,12,17-18,20-22H2,1-4H3/b15-9+/t25-,26+/m1/s1 |
| InChIKey | LNYXSOHOCLCUGW-HEBMBGLESA-N |
| Mol Weight | 496.6 g/mol |
| Molecular Formula | C30H40O6 |
| Exact Mass | 496.282489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eh15ehg2bMg |
|---|---|
| Name | METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-6,8-O-ISOPROPYLIDENE-1-UNDECENYL]-6-METHOXYBENZOATE |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O6 |
| InChI | InChI=1S/C30H40O6/c1-30(2)35-25(21-26(36-30)18-12-20-34-22-23-13-7-5-8-14-23)17-10-6-9-15-24-16-11-19-27(32-3)28(24)29(31)33-4/h5,7-9,11,13-16,19,25-26H,6,10,12,17-18,20-22H2,1-4H3/b15-9+/t25-,26+/m1/s1 |
| InChIKey | LNYXSOHOCLCUGW-HEBMBGLESA-N |
| Literature Reference Author | S.M.KUHNERT,M.E.MAIER |
| Literature Reference Citation | ORG.LETTERS,4,643(2002) |
| Literature Reference DOI | 10.1021/ol017261d |
| Molecular Weight | 496.644 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWLU35619 |