| SpectraBase Compound ID | CKBVVFDC2WR |
|---|---|
| InChI | InChI=1S/C27H30O14/c1-36-14-6-16(29)19-17(7-14)37-8-15(20(19)30)12-2-4-13(5-3-12)40-25-23(33)22(32)21(31)18(41-25)9-38-26-24(34)27(35,10-28)11-39-26/h2-8,18,21-26,28-29,31-35H,9-11H2,1H3/t18-,21-,22+,23-,24+,25-,26-,27-/m1/s1 |
| InChIKey | SKCGEXKDKBCXKB-NRIIMPDMSA-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 | 6pYbpqusoxc |
|---|---|
| Name | COROMANDELIN;PRUNETIN-4'-O-PIOSYL-(->6)-GLUCOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O14 |
| InChI | InChI=1S/C27H30O14/c1-36-14-6-16(29)19-17(7-14)37-8-15(20(19)30)12-2-4-13(5-3-12)40-25-23(33)22(32)21(31)18(41-25)9-38-26-24(34)27(35,10-28)11-39-26/h2-8,18,21-26,28-29,31-35H,9-11H2,1H3/t18-,21-,22+,23-,24+,25-,26-,27-/m1/s1 |
| InChIKey | SKCGEXKDKBCXKB-NRIIMPDMSA-N |
| Literature Reference Author | P.RAMESH,C.R.YUVARAJAN |
| Literature Reference Citation | J.NAT.PROD.,58,1240(1995) |
| Literature Reference DOI | 10.1021/np50122a012 |
| Molecular Weight | 578.527 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWPR1349 |