| SpectraBase Spectrum ID |
DAmcNb5f4Bk |
| Name |
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,8-trihydroxy-6-methyl-9,10-anthraquinone |
| Alternate Name(s) |
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,8-trihydroxy-6-methyl-anthracene-9,10-dione
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-6-methyl-1,3,8-tris(oxidanyl)anthracene-9,10-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H26O5 |
| InChI |
InChI=1S/C25H26O5/c1-13(2)6-5-7-14(3)8-9-16-19(26)12-18-22(24(16)29)25(30)21-17(23(18)28)10-15(4)11-20(21)27/h6,8,10-12,26-27,29H,5,7,9H2,1-4H3/b14-8+ |
| InChIKey |
YOYLZCNREONCKB-RIYZIHGNSA-N |
| Molecular Weight |
406.478 g/mol |
| SMILES |
Oc1c(c(cc2c1C(c1c(cc(cc1C2=O)C)O)=O)O)C\C=C\(CCC=C(C)C)C |
| SPLASH |
splash10-001i-0090100000-e6221bff2598d418cd55 |
| Source of Spectrum |
F-49-781-12 |
| Wiley ID |
1372327 |
![2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,8-trihydroxy-6-methyl-9,10-anthraquinone](/api/spectrum/DAmcNb5f4Bk/structure.png?h=300&w=458 "2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,8-trihydroxy-6-methyl-9,10-anthraquinone")
