SpectraBase Spectrum ID |
2mkQJELTLmb |
Name |
PSAMMAPLIN-A |
Compound Number |
4 |
Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula |
C22H22Br2N4O6S2 |
InChI |
InChI=1S/C22H24Br2N4O6S2/c23-15-9-13(1-3-19(15)29)11-17(27-33)21(31)25-5-7-35-36-8-6-26-22(32)18(28-34)12-14-2-4-20(30)16(24)10-14/h1-4,9-10,29-30,33-34H,5-8,11-12H2,(H,25,31)(H,26,32)/b27-17+,28-18+ |
InChIKey |
LMAFSGDNHVBIHU-XUIWWLCJSA-N |
Literature Reference Author |
I.C.PINA,J.T.GAUTSCHI,G.Y.S.WANG,M.L.SANDERS,F.J.SCHMITZ,D.F
RANCE,S.C.KENNON,L.C |
Literature Reference Citation |
J.ORG.CHEM.,68,3866(2003) |
Literature Reference DOI |
10.1021/jo034248t |
Molecular Weight |
662.368 g/mol |
Solvent |
CD3OD |
Source File Reference |
UWLU23215 |