| SpectraBase Compound ID | 3wEW1lNMlBF |
|---|---|
| InChI | InChI=1S/C23H36O12/c1-10(2)4-17(28)35-22-18-13(5-15(27)14(18)6-24)12(8-31-22)9-32-23-21(33-11(3)26)20(30)19(29)16(7-25)34-23/h8,10,13-16,18-25,27,29-30H,4-7,9H2,1-3H3/t13?,14-,15-,16-,18?,19-,20+,21-,22-,23-/m0/s1 |
| InChIKey | VQANSJBWIGQANR-UVJGQEETSA-N |
| Mol Weight | 504.5 g/mol |
| Molecular Formula | C23H36O12 |
| Exact Mass | 504.220677 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HRkhXPH9qgT |
|---|---|
| Name | 2'-O-ACETYL-PATRINOSIDE |
| Compound Number | 23 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H36O12 |
| InChI | InChI=1S/C23H36O12/c1-10(2)4-17(28)35-22-18-13(5-15(27)14(18)6-24)12(8-31-22)9-32-23-21(33-11(3)26)20(30)19(29)16(7-25)34-23/h8,10,13-16,18-25,27,29-30H,4-7,9H2,1-3H3/t13?,14-,15-,16-,18?,19-,20+,21-,22-,23-/m0/s1 |
| InChIKey | VQANSJBWIGQANR-UVJGQEETSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 504.532 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS4405 |