| SpectraBase Spectrum ID |
DQNUblaszpF |
| Name |
3,5,6-trihydroxy-2-methyl-1,4-naphthoquinone-6-O-.beta.-glucoside |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18O10 |
| InChI |
InChI=1S/C17H18O10/c1-5-10(19)6-2-3-7(12(21)9(6)14(23)11(5)20)26-17-16(25)15(24)13(22)8(4-18)27-17/h2-3,8,13,15-18,20-22,24-25H,4H2,1H3/t8-,13-,15+,16-,17-/m1/s1 |
| InChIKey |
WVYJNTPDOVALFJ-ACMQDLBVSA-N |
| Ionization Type |
EI |
| Optical Rotation |
[a]D20 = 67.2 (C= 0.05, DMSO/CH3OH, 1:1) |
| Reported Formula |
C17H18O10 |
| SMILES |
Oc1c2c(ccc1O[C@]1([C@@]([C@]([C@@]([C@](O1)(CO)[H])(O)[H])(O)[H])(O)[H])[H])C(C(=C(C2=O)O)C)=O |
| SPLASH |
splash10-00di-0690000000-c76cd359e44288b55203 |
| Source of Spectrum |
EP2252569A2 |
| Synonyms |
Dioncoquinone A |
| Wiley ID |
1872358 |
