| SpectraBase Spectrum ID |
EHoXXUut25I |
| Name |
17-(N-Methoxycarbamoyl)-3-methoxyestra-1,3,5(10),16-tetraene |
| Alternate Name(s) |
N,3-dimethoxyestra-1,3,5(10),16-tetraene-17-carboxamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27NO3 |
| InChI |
InChI=1S/C21H27NO3/c1-21-11-10-16-15-7-5-14(24-2)12-13(15)4-6-17(16)18(21)8-9-19(21)20(23)22-25-3/h5,7,9,12,16-18H,4,6,8,10-11H2,1-3H3,(H,22,23)/t16-,17-,18+,21+/m1/s1 |
| InChIKey |
HXBVZXHKNFEYNA-WIRSXHRWSA-N |
| Molecular Weight |
341.451 g/mol |
| SMILES |
N(C(C=1[C@@]2([C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OC)c4)[H])(CC1)[H])C)=O)OC |
| SPLASH |
splash10-0a4i-0009000000-da17e79ae4a02e80f62e |
| Source of Spectrum |
F-56-5256-4 |
| Wiley ID |
857858 |
