| SpectraBase Spectrum ID |
JPkC6s43zKt |
| Name |
3.alpha.-(E)-4-Hydroxysenecioyloxy-6.beta.-angeloyloxytropane |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H27NO5 |
| InChI |
InChI=1S/C18H27NO5/c1-5-12(3)18(22)24-16-8-13-7-14(9-15(16)19(13)4)23-17(21)6-11(2)10-20/h5-6,13-16,20H,7-10H2,1-4H3/b11-6+,12-5-/t13-,14-,15+,16-/m1/s1 |
| InChIKey |
BQBJPUJMIOEUKT-XRJVJNJHSA-N |
| Instrument Name |
Hewlett-Packard 5890 series II-Agilent Technologies HP 5972 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1005423 |
| Molecular Weight |
337.416 g/mol |
| Optical Rotation |
[a]D25 = -6.25 (c = 0.04, MeOH) |
| Reported Formula |
C18H27NO5 |
| SMILES |
OC\C(=C\C(O[C@@]1(C[C@@]2(C[C@@](OC(\C(=C/C)C)=O)([C@](C1)(N2C)[H])[H])[H])[H])=O)C |
| SPLASH |
splash10-0007-9100000000-293a7305b03465f49d6d |
| Source of Spectrum |
G4-74-52-1 |
| Synonyms |
Schizanthine N |
| Wiley ID |
1849014 |
