SpectraBase Compound ID | FsMXb5m1CF6 |
---|---|
InChI | InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15?,16?,17?,18?,19?,20?,21-,22?,23-,24-,25-,26?,27+/m0/s1 |
InChIKey | NEMWYOKGHGSVSC-SNWRYXGPSA-N |
Mol Weight | 415.7 g/mol |
Molecular Formula | C27H45NO2 |
Exact Mass | 415.34503 g/mol |
SpectraBase Spectrum ID | EmDlVz7qZSf |
---|---|
Name | Stenazidinine |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H45NO2 |
InChI | InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15?,16?,17?,18?,19?,20?,21-,22?,23-,24-,25-,26?,27+/m0/s1 |
InChIKey | NEMWYOKGHGSVSC-SNWRYXGPSA-N |
Molecular Weight | 415.662 g/mol |
SMILES | OC1C[C@]2(C3CCC4C([C@]5(N(CC4C3C[C@@]2([C@]2(CCC(C[C@@]12[H])O)C)[H])CC(CC5)C)[H])C)[H] |
SPLASH | splash10-0002-0509000000-5edfc1e0e6480130221d |
Source of Spectrum | X4-20-470-0 |
Wiley ID | 1585711 |