Analyte Name

Zankiren

CAS Number

138742-43-5

Molecular Formula

C35 H55 N5 O6 S2

Molecular Weight

705.971

Accurate Mass

705.359

SMILES

CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc2cscn2)NC(=O)[C@H](Cc3ccccc3)CS(=O)(=O)N4CCN(C)CC4

InChI

InChI=1S/C35H55N5O6S2/c1-25(2)18-32(41)33(42)30(20-27-12-8-5-9-13-27)37-35(44)31(21-29-22-47-24-36-29)38-34(43)28(19-26-10-6-4-7-11-26)23-48(45,46)40-16-14-39(3)15-17-40/h4,6-7,10-11,22,24-25,27-28,30-33,41-42H,5,8-9,12-21,23H2,1-3H3,(H,37,44)(H,38,43)/t2

IUPAC

(2S)-2-benzyl-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]amino]-1-oxo-3-(1,3-thiazol-4-yl)propan-2-yl]-3-(4-methylpiperazin-1-yl)sulfonylpropanamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat