| SpectraBase Compound ID | 4PcDxNsEB9F |
|---|---|
| InChI | InChI=1S/C28H42O6/c1-15(29)33-20-14-18-26(4)11-8-10-25(2,3)17(26)9-12-27(18,5)19-13-16(32-7)21-22(28(19,20)6)24(31)34-23(21)30/h16-20,24,31H,8-14H2,1-7H3/t16-,17?,18-,19+,20-,24-,26+,27-,28-/m1/s1 |
| InChIKey | AAGQILLTUBPRPF-GGTMZFJJSA-N |
| Mol Weight | 474.6 g/mol |
| Molecular Formula | C28H42O6 |
| Exact Mass | 474.298139 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1k5vEXsLZ9i |
|---|---|
| Name | 12-O-ACETYL-16-O-METHYLHYRTIOLIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2023 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O6 |
| InChI | InChI=1S/C28H42O6/c1-15(29)33-20-14-18-26(4)11-8-10-25(2,3)17(26)9-12-27(18,5)19-13-16(32-7)21-22(28(19,20)6)24(31)34-23(21)30/h16-20,24,31H,8-14H2,1-7H3/t16-,17?,18-,19+,20-,24-,26+,27-,28-/m1/s1 |
| InChIKey | AAGQILLTUBPRPF-GGTMZFJJSA-N |
| Literature Reference Author | S.TSUKAMOTO,S.MIURA,R.W.M.VANSOEST,T.OHTA |
| Literature Reference Citation | J.NAT.PROD.,66,438(2003) |
| Literature Reference DOI | 10.1021/np020497l |
| Molecular Weight | 474.638 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI4700 |