| SpectraBase Spectrum ID |
5E6pomEuyPe |
| Name |
O-methyl ether aglycon |
| Appearance |
Light yellowish film |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-13(2)8-7-9-14(3)17-11-10-15(4)19-18(17)12-16(5)20(22)21(19)23-6/h8,12,14-15,17,22H,7,9-11H2,1-6H3/t14-,15-,17+/m0/s1 |
| InChIKey |
XPXWFANWBQODET-YQQAZPJKSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np049802o |
| Optical Rotation |
[a]D20 = -4.7 (c = 1.1, CHCl3) |
| Reported Formula |
C21H32O2 |
| SMILES |
Oc1c(c2[C@](CC[C@@](c2cc1C)([C@](CCC=C(C)C)(C)[H])[H])(C)[H])OC |
| SPLASH |
splash10-0a4i-0191000000-1d57dfbb3afb918b2fef |
| Source of Spectrum |
G4-67-1679-19 |
| Wiley ID |
1881551 |
