| SpectraBase Compound ID | 228rJXNL5ks |
|---|---|
| InChI | InChI=1S/C32H48O7/c1-17(25-16-30(6)28(3,4)38-32(8,37-25)39-30)21-9-10-22-27-23(11-12-29(21,22)5)31(7)19(14-24(27)35)13-20(34)15-26(31)36-18(2)33/h13,17,21-27,35H,9-12,14-16H2,1-8H3/t17-,21+,22-,23-,24+,25-,26-,27-,29+,30-,31-,32+/m0/s1 |
| InChIKey | HEBROYHHPIXDBB-ZIBRWNSISA-N |
| Mol Weight | 544.7 g/mol |
| Molecular Formula | C32H48O7 |
| Exact Mass | 544.340004 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 | 1qZ8GptAr0U |
|---|---|
| Name | PETUNIASTERONE-S;(22R,24R)-1-ALPHA-ACETOXY-7-ALPHA,22,24,25-TETRAHYDROXY-ERGOST-4-EN-3-ONE-22,24,25-ORTHOACETATE |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O7 |
| InChI | InChI=1S/C32H48O7/c1-17(25-16-30(6)28(3,4)38-32(8,37-25)39-30)21-9-10-22-27-23(11-12-29(21,22)5)31(7)19(14-24(27)35)13-20(34)15-26(31)36-18(2)33/h13,17,21-27,35H,9-12,14-16H2,1-8H3/t17-,21+,22-,23-,24+,25-,26-,27-,29+,30-,31-,32+/m0/s1 |
| InChIKey | HEBROYHHPIXDBB-ZIBRWNSISA-N |
| Literature Reference Author | C.A.ELLIGER,A.C.WAISS,M.BENSON,R.Y.WONG |
| Literature Reference Citation | PHYTOCHEM.,33,471(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85542-Y |
| Molecular Weight | 544.729 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN6448 |