| SpectraBase Compound ID | D4yGHdI3lCF |
|---|---|
| InChI | InChI=1S/C28H30O13/c1-13-22(16(30)7-9-35-13)40-27-25(21(34)20(33)17(11-29)38-27)41-28(2,3)18(31)12-37-26-23-15(6-8-36-23)10-14-4-5-19(32)39-24(14)26/h4-10,17-18,20-21,25,27,29,31,33-34H,11-12H2,1-3H3/t17-,18?,20-,21+,25-,27+/m1/s1 |
| InChIKey | TVYVCVYVQZGQGT-DLRDQZIBSA-N |
| Mol Weight | 574.54 g/mol |
| Molecular Formula | C28H30O13 |
| Exact Mass | 574.168641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ITGFFSMygdd |
|---|---|
| Name | PABULARIN-C |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H30O13 |
| InChI | InChI=1S/C28H30O13/c1-13-22(16(30)7-9-35-13)40-27-25(21(34)20(33)17(11-29)38-27)41-28(2,3)18(31)12-37-26-23-15(6-8-36-23)10-14-4-5-19(32)39-24(14)26/h4-10,17-18,20-21,25,27,29,31,33-34H,11-12H2,1-3H3/t17-,18?,20-,21+,25-,27+/m1/s1 |
| InChIKey | TVYVCVYVQZGQGT-DLRDQZIBSA-N |
| Literature Reference Author | Y.TADA,Y.SHIKISHIMA,Y.TAKAISHI,H.SHIBATA,T.HIGUTI,G.HONDA,M. ITO,Y.TAKEDA,O.K.KOD |
| Literature Reference Citation | PHYTOCHEM.,59,649(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00023-7 |
| Molecular Weight | 574.538 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN2769 |