| SpectraBase Spectrum ID |
C7qZBYH8aiq |
| Name |
19(R)-Methoxytubotaiwine |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26N2O3 |
| InChI |
InChI=1S/C21H26N2O3/c1-12(25-2)16-13-8-10-23-11-9-21(19(16)23)14-6-4-5-7-15(14)22-18(21)17(13)20(24)26-3/h4-7,12-13,16,19,22H,8-11H2,1-3H3/t12-,13+,16+,19-,21-/m1/s1 |
| InChIKey |
LTOOPESWVADEAE-NMAQRDEPSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0702234 |
| Molecular Weight |
354.450 g/mol |
| Optical Rotation |
[a]D = +442 (c = 0.14, CHCl3) |
| Reported Formula |
C21H26N2O3 |
| SMILES |
N1C=2[C@@]3(c4ccccc14)[C@]1([C@]([C@@](C2C(=O)OC)(CCN1CC3)[H])([C@@](C)(OC)[H])[H])[H] |
| SPLASH |
splash10-0fl3-9445000000-6edf0e5bcd759f48900f |
| Source of Spectrum |
G4-70-1305-3 |
| Wiley ID |
1874618 |
