| SpectraBase Compound ID | Kro2ggSH857 |
|---|---|
| InChI | InChI=1S/C28H39ClO8/c1-23-8-7-14-13(9-18(29)28(36)20(31)6-5-19(30)26(14,28)4)15(23)10-21(32)27(23,35)16-11-24(2)22(33)37-17(16)12-25(24,3)34/h5-6,13-18,20-21,31-32,34-36H,7-12H2,1-4H3/t13-,14+,15+,16+,17+,18+,20+,21-,23+,24-,25+,26+,27-,28+/m1/s1 |
| InChIKey | GFPFCWYNJCFMEV-QEDNFHQRSA-N |
| Mol Weight | 539.1 g/mol |
| Molecular Formula | C28H39ClO8 |
| Exact Mass | 538.233346 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 65pDpOxB4rq |
|---|---|
| Name | TUBONOLIDE_A |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H39ClO8 |
| InChI | InChI=1S/C28H39ClO8/c1-23-8-7-14-13(9-18(29)28(36)20(31)6-5-19(30)26(14,28)4)15(23)10-21(32)27(23,35)16-11-24(2)22(33)37-17(16)12-25(24,3)34/h5-6,13-18,20-21,31-32,34-36H,7-12H2,1-4H3/t13-,14+,15+,16+,17+,18+,20+,21-,23+,24-,25+,26+,27-,28+/m1/s1 |
| InChIKey | GFPFCWYNJCFMEV-QEDNFHQRSA-N |
| Literature Reference Author | P.W.HSIEH,Z.Y.HUANG,J.H.CHEN,F.R.CHANG,C.C.WU,Y.L.YANG,M.Y.C HIANG,M.H.YEN,S.L.CH |
| Literature Reference Citation | J.NAT.PROD.,70,747(2007) |
| Literature Reference DOI | 10.1021/np0605541 |
| Molecular Weight | 539.066 g/mol |
| Sample ID | 30234 |
| Solvent | C5D5N |