| SpectraBase Compound ID | IOXOfNzvWKP |
|---|---|
| InChI | InChI=1S/C27H46O4S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(31-32(28,29)30)13-15-26(20,4)25(22)14-16-27(23,24)5/h10,18-21,23-25H,6-9,11-17H2,1-5H3,(H,28,29,30)/t19-,20?,21+,23-,24?,25?,26+,27-/m1/s1 |
| InChIKey | KZFJOBSLEBZJMB-AUIPQBRQSA-N |
| Mol Weight | 466.7 g/mol |
| Molecular Formula | C27H46O4S |
| Exact Mass | 466.311681 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5g70PfywYN1 |
|---|---|
| Name | KZFJOBSLEBZJMB-AUIPQBRQSA-N |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O4S |
| InChI | InChI=1S/C27H46O4S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(31-32(28,29)30)13-15-26(20,4)25(22)14-16-27(23,24)5/h10,18-21,23-25H,6-9,11-17H2,1-5H3,(H,28,29,30)/t19-,20?,21+,23-,24?,25?,26+,27-/m1/s1 |
| InChIKey | KZFJOBSLEBZJMB-AUIPQBRQSA-N |
| Literature Reference Author | E.PALAGIANO,F.ZOLLO,L.MINALE,M.IORIZZI,P.BRYAN,J.MCCLINTOCK, T.HOPKINS |
| Literature Reference Citation | J.NAT.PROD.,59,348(1996) |
| Literature Reference DOI | 10.1021/np9601014 |
| Molecular Weight | 466.720 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS15396 |