| SpectraBase Spectrum ID |
JVkB0TULlh3 |
| Name |
Lachnone E |
| Appearance |
Yellow gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O8 |
| InChI |
InChI=1S/C18H20O8/c1-9(20)7-18(24)16(23)15-11(21)5-10(8-19)6-12(15)26-17(18,2)13-3-4-14(22)25-13/h5-6,13,19,21,24H,3-4,7-8H2,1-2H3/t13-,17-,18-/m0/s1 |
| InChIKey |
HOIRMAMFSJXDHK-KKXDTOCCSA-N |
| Instrument Name |
Thermofinnigan MAT 95 XL |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np060164e |
| Molecular Weight |
364.350 g/mol |
| Optical Rotation |
[a]D28 = +51.4 (c = 0.035, MeOH) |
| Reported Formula |
C18H20O8 |
| SMILES |
OCc1cc(c2c(c1)O[C@@]([C@](C2=O)(O)CC(C)=O)(C)[C@@]1(CCC(O1)=O)[H])O |
| SPLASH |
splash10-016r-1911000000-169fda2cb950f3f3ffcf |
| Source of Spectrum |
G4-69-982-5 |
| Wiley ID |
1874234 |
