| SpectraBase Spectrum ID |
4sZcW29gpc |
| Name |
9-(1"'-Heptyloctyl)-2-[2'-butyl-2'-(hydroxymethyl)hexyl}-anthra[2,1,9-def : 6,5,10-d'e'f']disiquinoline-1,3,8,10-tetraone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C50H62N2O5 |
| InChI |
InChI=1S/C50H62N2O5/c1-5-9-13-15-17-20-33(21-18-16-14-10-6-2)51-46(54)38-26-22-34-36-24-28-40-45-41(29-25-37(43(36)45)35-23-27-39(47(51)55)44(38)42(34)35)49(57)52(48(40)56)50(32-53,30-12-8-4)31-19-11-7-3/h22-29,33,53H,5-21,30-32H2,1-4H3 |
| InChIKey |
SELFJAPFROCRIN-UHFFFAOYSA-N |
| Molecular Weight |
771.055 g/mol |
| SMILES |
OCC(N1C(c2ccc3c4c2c(C1=O)ccc4c1c2c4c(C(=O)N(C(c4cc1)=O)C(CCCCCCC)CCCCCCC)ccc32)=O)(CCCCC)CCCC |
| SPLASH |
splash10-0fkc-0005201900-a17a2490a7d2f657f707 |
| Source of Spectrum |
H-2005-4318-3 |
| Wiley ID |
1587823 |
![9-(1"'-Heptyloctyl)-2-[2'-butyl-2'-(hydroxymethyl)hexyl}-anthra[2,1,9-def : 6,5,10-d'e'f']disiquinoline-1,3,8,10-tetraone](/api/spectrum/4sZcW29gpc/structure.png?h=300&w=458 "9-(1\"'-Heptyloctyl)-2-[2'-butyl-2'-(hydroxymethyl)hexyl}-anthra[2,1,9-def : 6,5,10-d'e'f']disiquinoline-1,3,8,10-tetraone")
