| SpectraBase Spectrum ID |
CqjEX7o0XIk |
| Name |
10-Demethoxy-12-hydroxy-17,19-epoxygeissovelline |
| Appearance |
Crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O5 |
| InChI |
InChI=1S/C22H28N2O5/c1-12-22(29-12)14-7-9-23(3)10-8-21(20(22)27)15-5-6-16(28-4)19(26)18(15)24(13(2)25)17(21)11-14/h5-6,12,14,17,26H,7-11H2,1-4H3/t12-,14?,17+,21+,22-/m0/s1 |
| InChIKey |
PCKNNBQTKQWZDD-AYVXYMQBSA-N |
| Instrument Name |
VG-Micromass ZAB 2F |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np300067m |
| Molecular Weight |
400.475 g/mol |
| Optical Rotation |
[a]D25 = +34 (c = 0.49, CHCl3) |
| Reported Formula |
C22H28N2O5 |
| SMILES |
Oc1c(ccc2c1N(C(C)=O)[C@]1([C@]22C([C@@]3(O[C@]3(C)[H])C(C1)CCN(CC2)C)=O)[H])OC |
| SPLASH |
splash10-0kdi-4349400000-08567475f4e19528e2be |
| Source of Spectrum |
G4-75-932-1 |
| Wiley ID |
1854795 |
