| SpectraBase Spectrum ID |
DBfqRaWshDa |
| Name |
1,3,4,6,8-Hexahydroxy-10,11-bis(nonadecyl-phenanthro[1,10,9,8-o,p,Q,R,A]-perylene-7,14-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
1008.647919786 u |
| Formula |
C66H88O8 |
| InChI |
InChI=1S/C66H88O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-43-39-45(67)55-59-51(43)52-44(38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)40-46(68)56-60(52)64-62-54(48(70)42-50(72)58(62)66(56)74)53-47(69)41-49(71)57(65(55)73)61(53)63(59)64/h39-42,67-72H,3-38H2,1-2H3 |
| InChIKey |
QRQSANHCANQTHK-UHFFFAOYSA-N |
| Molecular Weight |
1009.422 g/mol |
| SMILES |
C=12C(C=3C(=CC(=C4C3C=3C=5C6=C(C(O)=CC(=C46)CCCCCCCCCCCCCCCCCCC)C(C=4C5C(=C(C23)C(=CC1O)O)C(=CC4O)O)=O)CCCCCCCCCCCCCCCCCCC)O)=O |
![1,3,4,6,8-Hexahydroxy-10,11-bis(nonadecyl-phenanthro[1,10,9,8-o,p,q,r,a]-perylene-7,14-dione](/api/spectrum/DBfqRaWshDa/structure.png?h=300&w=458 "1,3,4,6,8-Hexahydroxy-10,11-bis(nonadecyl-phenanthro[1,10,9,8-o,p,q,r,a]-perylene-7,14-dione")
