| SpectraBase Compound ID | BTKlhhrsAX0 |
|---|---|
| InChI | InChI=1S/C27H30O14/c1-10(2)6-17(30)38-9-16-19(31)22(34)24(36)27(41-16)40-15-8-14-18(21(33)26(15)37-3)20(32)23(35)25(39-14)11-4-5-12(28)13(29)7-11/h4-5,7-8,10,16,19,22,24,27-29,31,33-36H,6,9H2,1-3H3/t16-,19-,22+,24-,27-/m1/s1 |
| InChIKey | SOEZANHKTWLRIX-BAHLFPRBSA-N |
| Mol Weight | 578.52 g/mol |
| Molecular Formula | C27H30O14 |
| Exact Mass | 578.163556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JkSZ0VF8VD |
|---|---|
| Name | PATULETIN-7-O-(6''-ISOVALERYL)-GLUCOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O14 |
| InChI | InChI=1S/C27H30O14/c1-10(2)6-17(30)38-9-16-19(31)22(34)24(36)27(41-16)40-15-8-14-18(21(33)26(15)37-3)20(32)23(35)25(39-14)11-4-5-12(28)13(29)7-11/h4-5,7-8,10,16,19,22,24,27-29,31,33-36H,6,9H2,1-3H3/t16-,19-,22+,24-,27-/m1/s1 |
| InChIKey | SOEZANHKTWLRIX-BAHLFPRBSA-N |
| Literature Reference Author | E.J.PARK,Y.KIM,J.KIM |
| Literature Reference Citation | J.NAT.PROD.,63,34(2000) |
| Literature Reference DOI | 10.1021/np990271r |
| Molecular Weight | 578.527 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU1651 |