SpectraBase Compound ID | KGv14gipc4m |
---|---|
InChI | InChI=1S/C31H30Br6N4O11/c1-48-24-16(34)5-30(26(44)21(24)36)7-18(40-51-30)28(46)38-9-13(42)11-50-23-14(32)3-12(4-15(23)33)20(43)10-39-29(47)19-8-31(52-41-19)6-17(35)25(49-2)22(37)27(31)45/h3-6,13,20,26-27,42-45H,7-11H2,1-2H3,(H,38,46)(H,39,47)/t13-,20?,26-,27+,30+,31-/m0/s1 |
InChIKey | TURTULDFIIAPTC-VPCDURRBSA-N |
Mol Weight | 1114.02 g/mol |
Molecular Formula | C31H30Br6N4O11 |
Exact Mass | 1107.701136 g/mol |
SpectraBase Spectrum ID | FKn7SIfdiW5 |
---|---|
Name | FISTULARIN-3 |
Compound Number | 46 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C31H30Br6N4O11 |
InChI | InChI=1S/C31H30Br6N4O11/c1-48-24-16(34)5-30(26(44)21(24)36)7-18(40-51-30)28(46)38-9-13(42)11-50-23-14(32)3-12(4-15(23)33)20(43)10-39-29(47)19-8-31(52-41-19)6-17(35)25(49-2)22(37)27(31)45/h3-6,13,20,26-27,42-45H,7-11H2,1-2H3,(H,38,46)(H,39,47)/t13-,20?,26-,27+,30+,31-/m0/s1 |
InChIKey | TURTULDFIIAPTC-VPCDURRBSA-N |
Literature Reference Author | N.S.LIRA,R.C.MONTES,J.F.TAVARES,M.S.D.SILVA,E.V.L.D.CUNHA,P. F.D.ATHAYDE-FILHO |
Literature Reference Citation | MAR.DRUGS,9,2316(2011) |
Literature Reference DOI | 10.3390/md9112316 |
Molecular Weight | 1114.023 g/mol |
Source File Reference | UWBT6918 |