| SpectraBase Spectrum ID |
33lsxY2scPF |
| Name |
6,7,38,39-Tetraacetoxy-41,42-bis(14-oxo-1-azacyclohexacosyl)-tricyclo[35.3.1.1(4,8)]dotetraconta-1(41),4,6,8(42),37,39-hexaen |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
1559.285549672 u |
| Formula |
C100H170N2O10 |
| InChI |
InChI=1S/C100H170N2O10/c1-85(103)109-95-83-89-77-78-90-84-96(110-86(2)104)100(112-88(4)106)94(98(90)102-81-69-59-49-39-29-25-33-43-53-63-73-92(108)74-64-54-44-34-26-30-40-50-60-70-82-102)76-66-56-46-36-22-20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-35-45-55-65-75-93(99(95)111-87(3)105)97(89)101-79-67-57-47-37-27-23-31-41-51-61-71-91(107)72-62-52-42-32-24-28-38-48-58-68-80-101/h83-84H,5-82H2,1-4H3 |
| InChIKey |
LAPMOAJAPAGQKJ-UHFFFAOYSA-N |
| Molecular Weight |
1560.464 g/mol |
| SMILES |
C12=C(C(=CC(=C2N2CCCCCCCCCCCCC(=O)CCCCCCCCCCCC2)CCC2=C(C(CCCCCCCCCCCCCCCCCCCCCCCCCCCC1)=C(C(=C2)OC(=O)C)OC(=O)C)N1CCCCCCCCCCCCC(=O)CCCCCCCCCCCC1)OC(=O)C)OC(=O)C |
![6,7,38,39-Tetraacetoxy-41,42-bis(14-oxo-1-azacyclohexacosyl)-tricyclo[35.3.1.1(4,8)]dotetraconta-1(41),4,6,8(42),37,39-hexaen](/api/spectrum/33lsxY2scPF/structure.png?h=300&w=458 "6,7,38,39-Tetraacetoxy-41,42-bis(14-oxo-1-azacyclohexacosyl)-tricyclo[35.3.1.1(4,8)]dotetraconta-1(41),4,6,8(42),37,39-hexaen")
