| SpectraBase Spectrum ID |
9HIJ7VMpFYA |
| Name |
(1R,2R,5S,6S,7S,10R)-1,2,15-Triacetoxyeudesma-3,11(13)-dien-6,12-olide |
| Appearance |
Gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O8 |
| InChI |
InChI=1S/C21H26O8/c1-10-15-6-7-21(5)17(18(15)29-20(10)25)14(9-26-11(2)22)8-16(27-12(3)23)19(21)28-13(4)24/h8,15-19H,1,6-7,9H2,2-5H3/t15-,16+,17+,18-,19-,21+/m0/s1 |
| InChIKey |
GTYQNTOYAREYPG-UCWVGABGSA-N |
| Instrument Name |
Varian Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np070154t |
| Molecular Weight |
406.431 g/mol |
| Optical Rotation |
[a]D = +26 (589 nm), +27 (578 nm), +30 (546 nm), +47 (436 nm), +62 (365 nm) (c = 0.52, CHCl3) |
| Reported Formula |
C21H26O8 |
| SMILES |
[C@]1([C@@]([C@]2([C@@]([C@@]3([C@](C(C(O3)=O)=C)(CC2)[H])[H])(C(=C1)COC(=O)C)[H])C)(OC(=O)C)[H])(OC(C)=O)[H] |
| SPLASH |
splash10-0006-2290000000-ee67013927e5f0576f90 |
| Source of Spectrum |
G4-70-1178-8b |
| Wiley ID |
1874589 |
