| SpectraBase Spectrum ID |
FISvFy2EYmI |
| Name |
3,4-Secocholest-5-en-3-al, 4,4'-azobis-, N,N'-dioxide, (E)- |
| CAS Registry Number |
82008-69-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C54H90N2O4 |
| InChI |
InChI=1S/C54H90N2O4/c1-37(2)15-11-17-39(5)45-23-25-47-43-21-19-41(51(7,29-13-33-57)49(43)27-31-53(45,47)9)35-55(59)56(60)36-42-20-22-44-48-26-24-46(40(6)18-12-16-38(3)4)54(48,10)32-28-50(44)52(42,8)30-14-34-58/h19-20,33-34,37-40,43-50H,11-18,21-32,35-36H2,1-10H3/b56-55+ |
| InChIKey |
HPMHXHYXZYEFDN-WCNVQLFYSA-N |
| Molecular Weight |
831.324 g/mol |
| SMILES |
C(\[N+](=[N+]\(CC=1C(C2CCC3(C(C2CC1)CCC3C(CCCC(C)C)C)C)(CCC=O)C)[O-])[O-])C=1C(C2CCC3(C(C2CC1)CCC3C(CCCC(C)C)C)C)(CCC=O)C |
| SPLASH |
splash10-014i-0003900000-0582a08877427f28a3b9 |
| Source of Spectrum |
KC-1982-115-0 |
| Synonyms |
(E)-4,4'-azodi-(3,4-secocholest-5-en-3-one) N,N'-dioxide
1-[6,10-dimethyl-5-(6-methylheptan-2-yl)-10-(3-oxopropyl)tricyclo[7.4.0.0(2,6)]tridec-11-en-11-yl]-N-({[6,10-dimethyl-5-(6-methylheptan-2-yl)-10-(3-oxopropyl)tricyclo[7.4.0.0(2,6)]tridec-11-en-11-yl]methyl}-oxo-azanylidene)methanimine oxide |
| Wiley ID |
1417533 |
