| SpectraBase Compound ID | 6gdItFjLPpx |
|---|---|
| InChI | InChI=1S/C21H27N3O8/c1-2-11-12-5-15-23(4-3-10-6-22-9-24(10)15)19(29)13(12)8-30-20(11)32-21-18(28)17(27)16(26)14(7-25)31-21/h2,6,8-9,11-12,14-18,20-21,25-28H,1,3-5,7H2/t11-,12+,14+,15+,16+,17-,18+,20+,21-/m1/s1 |
| InChIKey | OKLMOHGEJOTZBW-XLSVPXCSSA-N |
| Mol Weight | 449.46 g/mol |
| Molecular Formula | C21H27N3O8 |
| Exact Mass | 449.179815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Kicm2w6STC |
|---|---|
| Name | NEOHISTELOSAMIDE |
| Compound Number | 8C |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H27N3O8 |
| InChI | InChI=1S/C21H27N3O8/c1-2-11-12-5-15-23(4-3-10-6-22-9-24(10)15)19(29)13(12)8-30-20(11)32-21-18(28)17(27)16(26)14(7-25)31-21/h2,6,8-9,11-12,14-18,20-21,25-28H,1,3-5,7H2/t11-,12+,14+,15+,16+,17-,18+,20+,21-/m1/s1 |
| InChIKey | OKLMOHGEJOTZBW-XLSVPXCSSA-N |
| Literature Reference Author | G.BEKE,L.F.SZABO,B.PODANYI |
| Literature Reference Citation | J.NAT.PROD.,65,649(2002) |
| Literature Reference DOI | 10.1021/np010415d |
| Molecular Weight | 449.461 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4144 |