SpectraBase Spectrum ID |
9euCZ6IaOmY |
Name |
1-(1'-Hexylheptyl)-8-[2"-hexyl-2"-(hydroxymethyl)octyl]-1H-indolo[5',4',3' : 10,5,6]anthra[2,1,9-def]isoquinoline-2,7,9 (8H)-trione |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C51H66N2O4 |
InChI |
InChI=1S/C51H66N2O4/c1-5-9-13-17-21-33-51(34-54,32-20-16-12-8-4)53-49(56)40-27-24-36-38-26-29-42-47-43(52(48(42)55)35(22-18-14-10-6-2)23-19-15-11-7-3)31-30-39(45(38)47)37-25-28-41(50(53)57)46(40)44(36)37/h24-31,35,54H,5-23,32-34H2,1-4H3 |
InChIKey |
SOSXDSWARUTLRK-UHFFFAOYSA-N |
Molecular Weight |
771.099 g/mol |
SMILES |
OCC(N1C(c2ccc3c4c2c(C1=O)ccc4c1c2c4c(C(=O)N(c4cc1)C(CCCCCC)CCCCCC)ccc32)=O)(CCCCCCC)CCCCCC |
SPLASH |
splash10-00di-0002020900-7e02e9cfac9c029ddc02 |
Source of Spectrum |
H-2005-4320-4 |
Wiley ID |
1587819 |