![METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-1-UNDECENYL]-6-METHOXYBENZOATE](/api/spectrum/5EoKsElyKOe/structure.png?h=300&w=458 "METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-1-UNDECENYL]-6-METHOXYBENZOATE")
| SpectraBase Compound ID | IpWW2BpM7Xb |
|---|---|
| InChI | InChI=1S/C27H36O6/c1-31-25-17-9-14-22(26(25)27(30)32-2)13-7-4-8-15-23(28)19-24(29)16-10-18-33-20-21-11-5-3-6-12-21/h3,5-7,9,11-14,17,23-24,28-29H,4,8,10,15-16,18-20H2,1-2H3/b13-7+/t23-,24+/m0/s1 |
| InChIKey | BVDFRCSWFPZKGJ-WCWZCQTQSA-N |
| Mol Weight | 456.6 g/mol |
| Molecular Formula | C27H36O6 |
| Exact Mass | 456.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5EoKsElyKOe |
|---|---|
| Name | METHYL-2-[(1E,6R,8S)-11-(BENZYLOXY)-6,8-DIHYDROXY-1-UNDECENYL]-6-METHOXYBENZOATE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O6 |
| InChI | InChI=1S/C27H36O6/c1-31-25-17-9-14-22(26(25)27(30)32-2)13-7-4-8-15-23(28)19-24(29)16-10-18-33-20-21-11-5-3-6-12-21/h3,5-7,9,11-14,17,23-24,28-29H,4,8,10,15-16,18-20H2,1-2H3/b13-7+/t23-,24+/m0/s1 |
| InChIKey | BVDFRCSWFPZKGJ-WCWZCQTQSA-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 | 456.579 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWLU35620 |