| SpectraBase Compound ID | 4y1SGGBM7Ti |
|---|---|
| InChI | InChI=1S/C25H30N2O8/c1-14-10-11-18-22(33-18)24(35-25(26)30)23(21-17(32-21)8-5-6-12-28)34-20(29)9-4-3-7-16-15(2)31-19(13-14)27-16/h3-5,7-9,13,17-18,21-24,28H,6,10-12H2,1-2H3,(H2,26,30)/b7-3+,8-5+,9-4-,14-13-/t17-,18+,21-,22-,23-,24+/m0/s1 |
| InChIKey | PCKNJAACMSPFNB-XBQQNXIXSA-N |
| Mol Weight | 486.52 g/mol |
| Molecular Formula | C25H30N2O8 |
| Exact Mass | 486.200216 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7W7h0dMvtsb |
|---|---|
| Name | PCKNJAACMSPFNB-XBQQNXIXSA-N |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30N2O8 |
| InChI | InChI=1S/C25H30N2O8/c1-14-10-11-18-22(33-18)24(35-25(26)30)23(21-17(32-21)8-5-6-12-28)34-20(29)9-4-3-7-16-15(2)31-19(13-14)27-16/h3-5,7-9,13,17-18,21-24,28H,6,10-12H2,1-2H3,(H2,26,30)/b7-3+,8-5+,9-4-,14-13-/t17-,18+,21-,22-,23-,24+/m0/s1 |
| InChIKey | PCKNJAACMSPFNB-XBQQNXIXSA-N |
| Literature Reference Author | L.G.ZAR,A.BISHARA,M.AKNIN,D.NEUMANN,N.BEN-CALIFA,Y.KASHMAN |
| Literature Reference Citation | MAR.DRUGS,11,4487(2013) |
| Literature Reference DOI | 10.3390/md11114487 |
| Molecular Weight | 486.522 g/mol |
| Source File Reference | UWBT6621 |