| SpectraBase Spectrum ID |
ETjRX8jiIAq |
| Name |
BIOT-4-(ORTHO);2-[5-(2-OXO-HEXAHYDROTHIENO-[3,4-D]-IMIDAZOL-6-YL)-PENTANOYLAMINO]-BENZOIC-ACID |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C17H21N3O4S |
| InChI |
InChI=1S/C17H21N3O4S/c21-14(18-11-6-2-1-5-10(11)16(22)23)8-4-3-7-13-15-12(9-25-13)19-17(24)20-15/h1-2,5-6,12-13,15H,3-4,7-9H2,(H,18,21)(H,22,23)(H2,19,20,24)/t12-,13-,15-/m0/s1 |
| InChIKey |
YDYCRDUTZCOPCY-YDHLFZDLSA-N |
| Literature Reference Author |
M.SKANDER,N.HUMBERT,J.COLLOT,J.GRADINARU,G.KLEIN,A.LOOSLI,J.
SAUSER,A.ZOCCHI,F.GI |
| Literature Reference Citation |
J.AM.CHEM.SOC.,126,14411(2004) |
| Literature Reference DOI |
10.1021/ja0476718 |
| Molecular Weight |
363.431 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWVN32480 |
![BIOT-4-(ORTHO);2-[5-(2-OXO-HEXAHYDROTHIENO-[3,4-D]-IMIDAZOL-6-YL)-PENTANOYLAMINO]-BENZOIC-ACID](/api/spectrum/ETjRX8jiIAq/structure.png?h=300&w=458 "BIOT-4-(ORTHO);2-[5-(2-OXO-HEXAHYDROTHIENO-[3,4-D]-IMIDAZOL-6-YL)-PENTANOYLAMINO]-BENZOIC-ACID")
