| SpectraBase Compound ID | 89brRB4c8tj |
|---|---|
| InChI | InChI=1S/C29H42O9/c1-8-9-10-11-12-16(2)24-28(38-20(6)32)27(35)23-25(21(37-19(5)31)15-17(3)26(23)34)29(24,7)22(33)13-14-36-18(4)30/h13-14,16-17,21,23,25-26,34H,8-12,15H2,1-7H3/b14-13+/t16-,17+,21-,23-,25+,26+,29+/m1/s1 |
| InChIKey | RZIRMWDPWGPIDI-FAXSZQMFSA-N |
| Mol Weight | 534.6 g/mol |
| Molecular Formula | C29H42O9 |
| Exact Mass | 534.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HzkGPQcwZNj |
|---|---|
| Name | AUSTRALIFUNGIN-TRIACETATE;MAJOR-CONFORMERE |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O9 |
| InChI | InChI=1S/C29H42O9/c1-8-9-10-11-12-16(2)24-28(38-20(6)32)27(35)23-25(21(37-19(5)31)15-17(3)26(23)34)29(24,7)22(33)13-14-36-18(4)30/h13-14,16-17,21,23,25-26,34H,8-12,15H2,1-7H3/b14-13+/t16-,17+,21-,23-,25+,26+,29+/m1/s1 |
| InChIKey | RZIRMWDPWGPIDI-FAXSZQMFSA-N |
| Literature Reference Author | O.D.HENSENS,G.L.HELMS,E.T.TURNER-JONES,G.H.HARRIS |
| Literature Reference Citation | J.ORG.CHEM.,60,1772(1995) |
| Literature Reference DOI | 10.1021/jo00111a040 |
| Molecular Weight | 534.647 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWGE649 |