Analyte Name

(2S)-N-((2S)-3-(2-amino-1,3-thiazol-4-yl)-1-(((2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl)amino)-1-oxopropan-2-yl)-2-(morpholin-4-ylsulfonylamino)-3-phenylpropanamide

CAS Number

135704-06-2

Molecular Formula

C33 H52 N6 O7 S2

Molecular Weight

708.932

Accurate Mass

708.334

SMILES

CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc2csc(N)n2)NC(=O)[C@H](Cc3ccccc3)NS(=O)(=O)N4CCOCC4

InChI

InChI=1S/C33H52N6O7S2/c1-22(2)17-29(40)30(41)26(18-23-9-5-3-6-10-23)36-31(42)27(20-25-21-47-33(34)35-25)37-32(43)28(19-24-11-7-4-8-12-24)38-48(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-23,26-30,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,35)(H,36,42)(H,37,43)/t26-,27-,28-,29-,30+/m0/s1

IUPAC

(2S)-N-[(2S)-3-(2-amino-1,3-thiazol-4-yl)-1-[[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]amino]-1-oxopropan-2-yl]-2-(morpholin-4-ylsulfonylamino)-3-phenylpropanamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat