| SpectraBase Compound ID | AYfX9aZXAeu |
|---|---|
| InChI | InChI=1S/C33H50O9/c1-9-25(10-2)17-26(34)16-20(4)15-19(3)11-13-28(35)23(7)30(37)18-29(36)21(5)24(8)41-31(38)14-12-27-22(6)32(39)42-33(27)40/h9,17,19-21,23-24,28-29,35-36H,1,10-16,18H2,2-8H3/b25-17+/t19-,20+,21+,23-,24+,28-,29+/m0/s1 |
| InChIKey | JRPPQSKIGUCXKH-VDWAHYHUSA-N |
| Mol Weight | 590.8 g/mol |
| Molecular Formula | C33H50O9 |
| Exact Mass | 590.345483 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K2ohyoAJWrs |
|---|---|
| Name | 3'-DESHYDROXY-TAUTOMYCETIN;TTN_M-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O9 |
| InChI | InChI=1S/C33H50O9/c1-9-25(10-2)17-26(34)16-20(4)15-19(3)11-13-28(35)23(7)30(37)18-29(36)21(5)24(8)41-31(38)14-12-27-22(6)32(39)42-33(27)40/h9,17,19-21,23-24,28-29,35-36H,1,10-16,18H2,2-8H3/b25-17+/t19-,20+,21+,23-,24+,28-,29+/m0/s1 |
| InChIKey | JRPPQSKIGUCXKH-VDWAHYHUSA-N |
| Literature Reference Author | W.LI,Y.LUO,J.JU,S.R.RAJSKI,H.OSADA,B.SHEN |
| Literature Reference Citation | J.NAT.PROD.,72,450(2009) |
| Literature Reference DOI | 10.1021/np8007478 |
| Molecular Weight | 590.755 g/mol |
| Sample ID | 32281 |
| Solvent | CDCl3 |