| SpectraBase Compound ID | 9eSiHmSKKSC |
|---|---|
| InChI | InChI=1S/C32H34F3NO8/c1-16(41-28(38)30(40-5,32(33,34)35)19-9-7-6-8-10-19)11-13-29-21-12-14-36(29)20-15-22(29)43-31(21)23(20)17(2)25(44-31)26-24(39-4)18(3)27(37)42-26/h6-11,13,16-17,20-23H,12,14-15H2,1-5H3/b13-11+,26-25-/t16?,17-,20-,21+,22+,23+,29-,30-,31+/m0/s1 |
| InChIKey | ANDUJAMWAHSEQE-LCMRMBPMSA-N |
| Mol Weight | 617.6 g/mol |
| Molecular Formula | C32H34F3NO8 |
| Exact Mass | 617.223652 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kdrzyi8Vg1G |
|---|---|
| Name | ANDUJAMWAHSEQE-LCMRMBPMSA-N |
| Compound Number | (R,S)-9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H34F3NO8 |
| InChI | InChI=1S/C32H34F3NO8/c1-16(41-28(38)30(40-5,32(33,34)35)19-9-7-6-8-10-19)11-13-29-21-12-14-36(29)20-15-22(29)43-31(21)23(20)17(2)25(44-31)26-24(39-4)18(3)27(37)42-26/h6-11,13,16-17,20-23H,12,14-15H2,1-5H3/b13-11+,26-25-/t16?,17-,20-,21+,22+,23+,29-,30-,31+/m0/s1 |
| InChIKey | ANDUJAMWAHSEQE-LCMRMBPMSA-N |
| Literature Reference Author | M.C.BAIRD,S.G.PYNE,A.T.UNG,W.LIE,T.SASTRARUJI,A.JATISATIENR, C.JATISATIENR,S.DHEE |
| Literature Reference Citation | J.NAT.PROD.,72,679(2009) |
| Literature Reference DOI | 10.1021/np800806b |
| Molecular Weight | 617.619 g/mol |
| Sample ID | 32430 |
| Solvent | CDCl3 |