| SpectraBase Compound ID | BYGDBQGm9dr |
|---|---|
| InChI | InChI=1S/C28H42O6/c1-16-14-23(32-5)24(30)25(33-16)34-19-8-11-26(3)18(15-19)6-7-20-21(26)9-12-27(4)22(20)10-13-28(27,31)17(2)29/h6,14,16-17,19-22,25,29,31H,7-13,15H2,1-5H3/t16-,17?,19+,20-,21+,22+,25+,26+,27+,28+/m1/s1 |
| InChIKey | BKSQGHJUZLOGBO-GPUXCNPWSA-N |
| Mol Weight | 474.6 g/mol |
| Molecular Formula | C28H42O6 |
| Exact Mass | 474.298139 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DggePhI4wko |
|---|---|
| Name | PERIPLOCOGENIN;3-BETA-O-(4',6'-DIDEOXY-3'-O-METHYL-DELTA(3')-D-2'-HEXOSULOSYL)-DELTA(5)-PREGNENE-17-ALPHA,20(S)-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O6 |
| InChI | InChI=1S/C28H42O6/c1-16-14-23(32-5)24(30)25(33-16)34-19-8-11-26(3)18(15-19)6-7-20-21(26)9-12-27(4)22(20)10-13-28(27,31)17(2)29/h6,14,16-17,19-22,25,29,31H,7-13,15H2,1-5H3/t16-,17?,19+,20-,21+,22+,25+,26+,27+,28+/m1/s1 |
| InChIKey | BKSQGHJUZLOGBO-GPUXCNPWSA-N |
| Literature Reference Author | H.ITOKAWA,J.XU,K.TAKEYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,35,4524(1987) |
| Literature Reference DOI | 10.1248/cpb.35.4524 |
| Molecular Weight | 474.638 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK55 |