Analyte Name

Thiol modifier- (D-ala-aib)5-TOAC

Molecular Formula

C44H77N11O13S

Molecular Weight

1000.22

Accurate Mass

999.54

SMILES

SCCC(N[C@@H](C(NC(C)(C(N[C@H](C(NC(C)(C(N[C@H](C(NC(C)(C(N[C@H](C(NC(C)(C(N[C@H](C(NC(CC1(C)C)(C(O)=O)CC([NH+]1[O-])(C)C)=O)C)=O)C)=O)C)=O)C)=O)C)=O)C)=O)C)=O)C)=O)C)=O

InChI

InChI=1S/C44H77N11O13S/c1-22(45-27(56)18-19-69)28(57)50-40(10,11)33(62)46-23(2)29(58)51-41(12,13)34(63)47-24(3)30(59)52-42(14,15)35(64)48-25(4)31(60)53-43(16,17)36(65)49-26(5)32(61)54-44(37(66)67)20-38(6,7)55(68)39(8,9)21-44/h22-26,55,69H,18-21H2,1-17H3,(H,45,56)(H,46,62)(H,47,63)(H,48,64)(H,49,65)(H,50,57)(H,51,58)(H,52,59)(H,53,60)(H,54,61)(H,66,67)/t22-,23+,24+,25+,26+/m1/s1

IUPAC

4-carboxy-4-((2S,8S,14S,20S,26R)-30-mercapto-2,5,5,8,11,11,14,17,17,20,23,23,26-tridecamethyl-4,7,10,13,16,19,22,25,28-nonaoxo-3,6,9,12,15,18,21,24,27-nonaazatriacontanamido)-2,2,6,6-tetramethylpiperidine 1-oxide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat