| SpectraBase Compound ID | Gsbk87DG03m |
|---|---|
| InChI | InChI=1S/C20H29N11O6/c1-8(20(36)37)28-18(34)12(2-9-5-25-7-27-9)30-19(35)13-3-14(22)31-17(29-13)11(4-15(23)32)26-6-10(21)16(24)33/h3,5,7-8,10-12,26H,2,4,6,21H2,1H3,(H2,23,32)(H2,24,33)(H,25,27)(H,28,34)(H,30,35)(H,36,37)(H2,22,29,31) |
| InChIKey | DWBCJNOVGHHBAQ-UHFFFAOYSA-N |
| Mol Weight | 519.52 g/mol |
| Molecular Formula | C20H29N11O6 |
| Exact Mass | 519.230228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1MpbIoSYnjH |
|---|---|
| Name | (+)-P-3A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H29N11O6 |
| InChI | InChI=1S/C20H29N11O6/c1-8(20(36)37)28-18(34)12(2-9-5-25-7-27-9)30-19(35)13-3-14(22)31-17(29-13)11(4-15(23)32)26-6-10(21)16(24)33/h3,5,7-8,10-12,26H,2,4,6,21H2,1H3,(H2,23,32)(H2,24,33)(H,25,27)(H,28,34)(H,30,35)(H,36,37)(H2,22,29,31) |
| InChIKey | DWBCJNOVGHHBAQ-UHFFFAOYSA-N |
| Literature Reference Author | D.L.BOGER,T.HONDA,R.F.MENEZES,S.L.COLLETTI,Q.DANG,W.YANG |
| Literature Reference Citation | J.AM.CHEM.SOC.,116,82(1994) |
| Literature Reference DOI | 10.1021/ja00080a010 |
| Molecular Weight | 519.520 g/mol |
| Solvent | D2O |
| Source File Reference | UWRU6900 |