| SpectraBase Spectrum ID |
5lYGYhfqbmo |
| Name |
2,9-bis[2'-Hexyl-2'-(hydroxymethyl)octyl]-anthra[2,1,9-def : 6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C54H70N2O6 |
| InChI |
InChI=1S/C54H70N2O6/c1-5-9-13-17-29-53(35-57,30-18-14-10-6-2)33-55-49(59)41-25-21-37-39-23-27-43-48-44(28-24-40(46(39)48)38-22-26-42(50(55)60)47(41)45(37)38)52(62)56(51(43)61)34-54(36-58,31-19-15-11-7-3)32-20-16-12-8-4/h21-28,57-58H,5-20,29-36H2,1-4H3 |
| InChIKey |
LRRVFRWRXUVFJN-UHFFFAOYSA-N |
| Molecular Weight |
843.162 g/mol |
| SMILES |
OCC(CN1C(c2ccc3c4ccc5C(N(CC(CO)(CCCCCC)CCCCCC)C(c6ccc(c7c3c2c(C1=O)cc7)c4c56)=O)=O)=O)(CCCCCC)CCCCCC |
| SPLASH |
splash10-01ox-0004001090-b24fe3d0c805ddfb964d |
| Source of Spectrum |
H-2005-4316-2 |
| Wiley ID |
1563246 |
![2,9-bis[2'-Hexyl-2'-(hydroxymethyl)octyl]-anthra[2,1,9-def : 6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone](/api/spectrum/5lYGYhfqbmo/structure.png?h=300&w=458 "2,9-bis[2'-Hexyl-2'-(hydroxymethyl)octyl]-anthra[2,1,9-def : 6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone")
