| SpectraBase Spectrum ID |
A4469vidNcl |
| Name |
9-(1"'-Heptyloctyl)-2-[2'-hexyl-2'-(hydroxymethyl)octyl}-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 |
C54H70N2O5 |
| InChI |
InChI=1S/C54H70N2O5/c1-5-9-13-17-20-24-37(25-21-18-14-10-6-2)55-50(58)42-30-26-38-40-28-32-44-49-45(33-29-41(47(40)49)39-27-31-43(51(55)59)48(42)46(38)39)53(61)56(52(44)60)54(36-57,34-22-16-12-8-4)35-23-19-15-11-7-3/h26-33,37,57H,5-25,34-36H2,1-4H3 |
| InChIKey |
ALROFBYLWQDEFO-UHFFFAOYSA-N |
| Molecular Weight |
827.163 g/mol |
| SMILES |
OCC(N1C(c2ccc3c4c2c(C1=O)ccc4c1c2c4c(C(=O)N(C(c4cc1)=O)C(CCCCCCC)CCCCCCC)ccc32)=O)(CCCCCCC)CCCCCC |
| SPLASH |
splash10-002f-0009300460-b01649498685c5c21ff1 |
| Source of Spectrum |
H-2005-4319-3 |
| Wiley ID |
1587822 |
![9-(1"'-Heptyloctyl)-2-[2'-hexyl-2'-(hydroxymethyl)octyl}-anthra[2,1,9-def : 6,5,10-d'e'f']disiquinoline-1,3,8,10-tetraone](/api/spectrum/A4469vidNcl/structure.png?h=300&w=458 "9-(1\"'-Heptyloctyl)-2-[2'-hexyl-2'-(hydroxymethyl)octyl}-anthra[2,1,9-def : 6,5,10-d'e'f']disiquinoline-1,3,8,10-tetraone")
