| SpectraBase Compound ID | JEsuFVmRYnS |
|---|---|
| InChI | InChI=1S/C25H26O13/c1-12(26)33-11-20-22(34-13(2)27)23(35-14(3)28)24(36-15(4)29)25(38-20)37-19-10-18-17(7-8-32-18)9-16(19)5-6-21(30)31/h5-10,20,22-25H,11H2,1-4H3,(H,30,31)/b6-5+/t20-,22-,23+,24-,25-/m1/s1 |
| InChIKey | IMCYFZRKFWMCDJ-STWYIMIDSA-N |
| Mol Weight | 534.47 g/mol |
| Molecular Formula | C25H26O13 |
| Exact Mass | 534.137341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMR0ZpQozHK |
|---|---|
| Name | PSORALIC-ACID-(1->6)-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H26O13 |
| InChI | InChI=1S/C25H26O13/c1-12(26)33-11-20-22(34-13(2)27)23(35-14(3)28)24(36-15(4)29)25(38-20)37-19-10-18-17(7-8-32-18)9-16(19)5-6-21(30)31/h5-10,20,22-25H,11H2,1-4H3,(H,30,31)/b6-5+/t20-,22-,23+,24-,25-/m1/s1 |
| InChIKey | IMCYFZRKFWMCDJ-STWYIMIDSA-N |
| Literature Reference Author | A.I.HAMED,I.V.SPRINGUEL,N.A.EL-EMARY |
| Literature Reference Citation | PHYTOCHEM.,50,887(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00521-4 |
| Molecular Weight | 534.474 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN1485 |