| SpectraBase Compound ID | 9px9sVxLdDZ |
|---|---|
| InChI | InChI=1S/C26H36O9/c1-12-18-15(34-23(12)32)9-14-13(19(18)28)5-6-17-25(2,7-4-8-26(14,17)3)11-33-24-22(31)21(30)20(29)16(10-27)35-24/h15-17,20-22,24,27,29-31H,4-11H2,1-3H3/t15-,16+,17-,20+,21-,22+,24+,25+,26+/m1/s1 |
| InChIKey | GVSBVIDYKKDTET-PENUVEGMSA-N |
| Mol Weight | 492.6 g/mol |
| Molecular Formula | C26H36O9 |
| Exact Mass | 492.235933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7OO2Ey8T6RJ |
|---|---|
| Name | PHLOGACANTHOSIDE_B;19-HYDROXY-14-OXOABIETA-8,13(15)-DIEN-16,12-OLIDE_19-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H36O9 |
| InChI | InChI=1S/C26H36O9/c1-12-18-15(34-23(12)32)9-14-13(19(18)28)5-6-17-25(2,7-4-8-26(14,17)3)11-33-24-22(31)21(30)20(29)16(10-27)35-24/h15-17,20-22,24,27,29-31H,4-11H2,1-3H3/t15-,16+,17-,20+,21-,22+,24+,25+,26+/m1/s1 |
| InChIKey | GVSBVIDYKKDTET-PENUVEGMSA-N |
| Literature Reference Author | X.H.YUAN,B.G.LI,X.Y.ZHANG,H.Y.QI,M.ZHOU,G.L.ZHANG |
| Literature Reference Citation | J.NAT.PROD.,68,86(2005) |
| Literature Reference DOI | 10.1021/np0497999 |
| Molecular Weight | 492.566 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8247 |