| SpectraBase Spectrum ID |
8Dg0lB2pjSq |
| Name |
rel-(7.alpha.,8.beta.,7'7.alpha.,8'.beta.)-5,7,4'-trihydroxy-4,6,3',5'-tetramethoxy-8,8'-epoxy-2,7'-cyclolignan |
| Alternate Name(s) |
Sacidumlignan C |
| Appearance |
White amorphous powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O8 |
| InChI |
InChI=1S/C22H26O8/c1-21-16(10-7-12(26-3)17(23)13(8-10)27-4)11-9-14(28-5)18(24)19(29-6)15(11)20(25)22(21,2)30-21/h7-9,16,20,23-25H,1-6H3/t16-,20+,21-,22+/m1/s1 |
| InChIKey |
KFJQDOGRKGBSSL-ZJMJOCHXSA-N |
| Instrument Name |
Finnigan MAT95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np049681s |
| Molecular Weight |
418.442 g/mol |
| Optical Rotation |
[a]D20 = -72 (c = 0.5, acetone) |
| Reported Formula |
C22H26O8 |
| SMILES |
O[C@]1(c2c([C@@](c3cc(c(c(c3)OC)O)OC)([C@@]3([C@]1(O3)C)C)[H])cc(c(c2OC)O)OC)[H] |
| SPLASH |
splash10-066r-0359600000-cdc953b618147a29df96 |
| Source of Spectrum |
G4-68-225-3 |
| Wiley ID |
1879525 |
