| SpectraBase Compound ID | 21xSQgRCbdh |
|---|---|
| InChI | InChI=1S/C25H36O4/c1-19(7-4-8-20(2)10-6-12-23-15-16-28-17-23)9-5-11-22-13-14-24(26)21(3)25(27)29-18-22/h7,10-11,15-17,21,24,26H,4-6,8-9,12-14,18H2,1-3H3/b19-7+,20-10+,22-11-/t21-,24-/m0/s1 |
| InChIKey | VRWCUJQWBMHNBO-MJGZZVEBSA-N |
| Mol Weight | 400.6 g/mol |
| Molecular Formula | C25H36O4 |
| Exact Mass | 400.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LvzDAukgFWO |
|---|---|
| Name | ASTAKOLACTIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36O4 |
| InChI | InChI=1S/C25H36O4/c1-19(7-4-8-20(2)10-6-12-23-15-16-28-17-23)9-5-11-22-13-14-24(26)21(3)25(27)29-18-22/h7,10-11,15-17,21,24,26H,4-6,8-9,12-14,18H2,1-3H3/b19-7+,20-10+,22-11-/t21-,24-/m0/s1 |
| InChIKey | VRWCUJQWBMHNBO-MJGZZVEBSA-N |
| Literature Reference Author | M.TSOUKATOU,H.SIAPI,C.VAGIAS,V.ROUSSIS |
| Literature Reference Citation | J.NAT.PROD.,66,444(2003) |
| Literature Reference DOI | 10.1021/np020471u |
| Molecular Weight | 400.558 g/mol |
| Solvent | Unknown |
| Source File Reference | UWSI4704 |