| SpectraBase Compound ID | HCgtQ4aGcKJ |
|---|---|
| InChI | InChI=1S/C27H32O14/c1-36-16-7-12(3-5-15(16)30)4-6-19(31)39-17-8-13(9-28)20-21(17)14(25(35)37-2)11-38-26(20)41-27-24(34)23(33)22(32)18(10-29)40-27/h3-8,11,17-18,20-24,26-30,32-34H,9-10H2,1-2H3/b6-4+/t17-,18+,20-,21+,22+,23-,24+,26+,27-/m0/s1 |
| InChIKey | QHRICBJWYCXFDR-ZGQUKARSSA-N |
| Mol Weight | 580.5 g/mol |
| Molecular Formula | C27H32O14 |
| Exact Mass | 580.179206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | xcP9U40zlS |
|---|---|
| Name | 6-O-FERULOYL-SCANDOSIDE_METHYLESTER;OLDENLANDOSIDE_II |
| Compound Number | 268 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H32O14 |
| InChI | InChI=1S/C27H32O14/c1-36-16-7-12(3-5-15(16)30)4-6-19(31)39-17-8-13(9-28)20-21(17)14(25(35)37-2)11-38-26(20)41-27-24(34)23(33)22(32)18(10-29)40-27/h3-8,11,17-18,20-24,26-30,32-34H,9-10H2,1-2H3/b6-4+/t17-,18+,20-,21+,22+,23-,24+,26+,27-/m0/s1 |
| InChIKey | QHRICBJWYCXFDR-ZGQUKARSSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 580.543 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ16236 |