| SpectraBase Compound ID | DgvHrlXjf21 |
|---|---|
| InChI | InChI=1S/C21H32O9/c1-8-10-4-5-21(3)13(6-11(23)9(2)14(21)18(10)30-19(8)27)29-20-17(26)16(25)15(24)12(7-22)28-20/h9-18,20,22-26H,1,4-7H2,2-3H3/t9-,10-,11-,12+,13+,14+,15+,16-,17+,18-,20-,21-/m0/s1 |
| InChIKey | CEDACXINXNXTDF-PNTLOSRKSA-N |
| Mol Weight | 428.5 g/mol |
| Molecular Formula | C21H32O9 |
| Exact Mass | 428.204633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GUlf2z1TRiM |
|---|---|
| Name | 3-BETA-HYDROXY-4-ALPHA-H,3-DIHYDROSANTAMARINE-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O9 |
| InChI | InChI=1S/C21H32O9/c1-8-10-4-5-21(3)13(6-11(23)9(2)14(21)18(10)30-19(8)27)29-20-17(26)16(25)15(24)12(7-22)28-20/h9-18,20,22-26H,1,4-7H2,2-3H3/t9-,10-,11-,12+,13+,14+,15+,16-,17+,18-,20-,21-/m0/s1 |
| InChIKey | CEDACXINXNXTDF-PNTLOSRKSA-N |
| Literature Reference Author | C.ZIDORN,E.P.ELLMERER-MUELLER,H.STUPPNER |
| Literature Reference Citation | PHYTOCHEM.,51,991(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00163-6 |
| Molecular Weight | 428.480 g/mol |
| Solvent | CD3OD |