| SpectraBase Compound ID | CV6XlxbIlbl |
|---|---|
| InChI | InChI=1S/C20H35NO13/c22-3-6-1-8(12(26)15(29)11(6)25)21-9-2-7(4-23)19(17(31)13(9)27)34-20-18(32)16(30)14(28)10(5-24)33-20/h1,7-32H,2-5H2/t7-,8+,9+,10-,11-,12+,13+,14+,15+,16+,17-,18-,19-,20+/m0/s1 |
| InChIKey | JARYYMUOCXVXNK-FEQHKGILSA-N |
| Mol Weight | 497.5 g/mol |
| Molecular Formula | C20H35NO13 |
| Exact Mass | 497.21084 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3kXLziprMR8 |
|---|---|
| Name | 4''-EPI-VALIDAMYCIN_A |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H35NO13 |
| InChI | InChI=1S/C20H35NO13/c22-3-6-1-8(12(26)15(29)11(6)25)21-9-2-7(4-23)19(17(31)13(9)27)34-20-18(32)16(30)14(28)10(5-24)33-20/h1,7-32H,2-5H2/t7-,8+,9+,10-,11-,12+,13+,14+,15+,16+,17-,18-,19-,20+/m0/s1 |
| InChIKey | JARYYMUOCXVXNK-FEQHKGILSA-N |
| Literature Reference Author | H.XU,K.MINAGAWA,L.BAI,Z.DENG,T.MAHMUD |
| Literature Reference Citation | J.NAT.PROD.,71,1233(2008) |
| Literature Reference DOI | 10.1021/np800185k |
| Molecular Weight | 497.497 g/mol |
| Sample ID | 28698 |
| Solvent | D2O |