| SpectraBase Compound ID | JuzKLuCmBWt |
|---|---|
| InChI | InChI=1S/C33H52O3.C32H50O3/c1-2-32(35)28-24-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-25-29-33(36)30-26-23-27-31-34;1-2-31(34)27-23-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-24-28-32(35)29-25-22-26-30-33/h1,3-4,24,28,32-36H,5-22,25,29,31H2;1,3,5,23,27,31-35H,4,6-21,24,28,30H2/b4-3-,28-24+;5-3-,27-23+/t32-,33?;31-,32?/m00/s1 |
| InChIKey | PJLGDCJUHOXLGO-ILSOUIPTSA-N |
| Mol Weight | 979.5 g/mol |
| Molecular Formula | C65H102O6 |
| Exact Mass | 978.767641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2BdVpEnxkEJ |
|---|---|
| Name | PELLYNOL-A+PELLYNOL-B;MIXTURE |
| Compound Number | 7+8 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H102O6 |
| InChI | InChI=1S/C33H52O3.C32H50O3/c1-2-32(35)28-24-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-25-29-33(36)30-26-23-27-31-34;1-2-31(34)27-23-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-24-28-32(35)29-25-22-26-30-33/h1,3-4,24,28,32-36H,5-22,25,29,31H2;1,3,5,23,27,31-35H,4,6-21,24,28,30H2/b4-3-,28-24+;5-3-,27-23+/t32-,33?;31-,32?/m00/s1 |
| InChIKey | PJLGDCJUHOXLGO-ILSOUIPTSA-N |
| Literature Reference Author | A.F.GABRIEL,Z.LI,R.KUSUDA,C.TANAKA,T.MIYAMOTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,63,469(2015) |
| Literature Reference DOI | 10.1248/cpb.c15-00203 |
| Molecular Weight | 979.521 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPA10076 |