| SpectraBase Spectrum ID |
8moWqQq7y8M |
| Name |
Maceneolignan B |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O5 |
| InChI |
InChI=1S/C21H22O5/c1-5-6-13-7-15-12(2)19(26-20(15)16(8-13)22-3)14-9-17(23-4)21-18(10-14)24-11-25-21/h5-10,12,19H,11H2,1-4H3/b6-5+/t12-,19-/m1/s1 |
| InChIKey |
UIWUAELYQAENKN-OTBILJLCSA-N |
| Instrument Name |
JMS-GCMate |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.6b00262 |
| Molecular Weight |
354.402 g/mol |
| Optical Rotation |
[a]D26 = +42 (c = 1.1, CHCl3) |
| Reported Formula |
C21H22O5 |
| SMILES |
c12cc(cc(c2OCO1)OC)[C@]1([C@@](c2c(O1)c(cc(c2)\C=C\C)OC)(C)[H])[H] |
| SPLASH |
splash10-0udi-0109000000-642002aed689468d2da9 |
| Source of Spectrum |
G4-79-2011-2 |
| Wiley ID |
1849382 |
