| SpectraBase Compound ID | InKJFaLCHNa |
|---|---|
| InChI | InChI=1S/C36H58O9/c1-20(9-8-13-32(2,3)43)21-12-14-35(7)30-24(39)17-23-22(36(30,19-38)16-15-34(21,35)6)10-11-26(33(23,4)5)45-31-29(42)28(41)27(40)25(18-37)44-31/h8,13,17,19-22,24-31,37,39-43H,9-12,14-16,18H2,1-7H3/b13-8+/t20-,21-,22-,24+,25-,26+,27-,28-,29-,30?,31+,34-,35+,36-/m1/s1 |
| InChIKey | PRZSJOSZIIULLH-PQKKSTMZSA-N |
| Mol Weight | 634.9 g/mol |
| Molecular Formula | C36H58O9 |
| Exact Mass | 634.408083 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HFsfkPGvNzJ |
|---|---|
| Name | 3-O-BETA-D-ALLOPYRANOSYL-7-BETA,25-DIHYDROXY-CUCURBITA-5,23-(E)-DIEN-19-AL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O9 |
| InChI | InChI=1S/C36H58O9/c1-20(9-8-13-32(2,3)43)21-12-14-35(7)30-24(39)17-23-22(36(30,19-38)16-15-34(21,35)6)10-11-26(33(23,4)5)45-31-29(42)28(41)27(40)25(18-37)44-31/h8,13,17,19-22,24-31,37,39-43H,9-12,14-16,18H2,1-7H3/b13-8+/t20-,21-,22-,24+,25-,26+,27-,28-,29-,30?,31+,34-,35+,36-/m1/s1 |
| InChIKey | PRZSJOSZIIULLH-PQKKSTMZSA-N |
| Literature Reference Author | L.HARINANTENAINA,M.TANAKA,S.TAKAOKA,M.ODA,O.MOGAMI,M.UCHIDA, Y.ASAKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1017(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1017 |
| Molecular Weight | 634.851 g/mol |
| Sample ID | 37224 |
| Solvent | C5D5N |