SpectraBase Compound ID | 5k6HS6qGI0K |
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InChI | InChI=1S/C25H43N3O2/c1-6-7-16-26-23(30)28(5)21-11-9-18-17-8-10-20-25(3,15-13-22(29)27(20)4)19(17)12-14-24(18,21)2/h17-21H,6-16H2,1-5H3,(H,26,30)/t17?,18?,19?,20?,21-,24-,25+/m0/s1 |
InChIKey | YYYKMHLXHOQSHD-MBISKJBISA-N |
Mol Weight | 417.6 g/mol |
Molecular Formula | C25H43N3O2 |
Exact Mass | 417.335528 g/mol |
SpectraBase Spectrum ID | JXw14gHLEVo |
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Name | 17.beta.-(Ureylene-N-methyl-N'-butyl)-4-methyl-4-aza-5-alpha.-androstan3-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C25H43N3O2 |
InChI | InChI=1S/C25H43N3O2/c1-6-7-16-26-23(30)28(5)21-11-9-18-17-8-10-20-25(3,15-13-22(29)27(20)4)19(17)12-14-24(18,21)2/h17-21H,6-16H2,1-5H3,(H,26,30)/t17?,18?,19?,20?,21-,24-,25+/m0/s1 |
InChIKey | YYYKMHLXHOQSHD-MBISKJBISA-N |
Molecular Weight | 417.638 g/mol |
SMILES | N(C(N([C@@]1([C@]2(CCC3[C@@]4(C(N(C(=O)CC4)C)CCC3C2CC1)C)C)[H])C)=O)CCCC |
SPLASH | splash10-014j-0097400000-c558576b19fa8b66f512 |
Source of Spectrum | G2-5-309-3h |
Wiley ID | 1705349 |