Analyte Name

Rifamdin-d9

Molecular Formula

C46H55D9N4O12

Molecular Weight

874.08

Accurate Mass

873.51

SMILES

OC1=C(C2=C(C3=C(C(C)=C(C4=C31)O[C@@](C)(C4=O)O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(C(N2)=O)/C)C)O)C)O)C)OC(C)=O)C)OC)O)O)/C=N/N5CCN(CC5)C([2H])(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H])[2H]

InChI

InChI=1S/C46H64N4O12/c1-23(2)22-49-16-18-50(19-17-49)47-21-31-36-41(56)34-33(40(31)55)35-43(29(8)39(34)54)62-46(10,44(35)57)60-20-15-32(59-11)26(5)42(61-30(9)51)28(7)38(53)27(6)37(52)24(3)13-12-14-25(4)45(58)48-36/h12-15,20-21,23-24,26-28,32,37-38,42,52-56H,16-19,22H2,1-11H3,(H,48,58)/b13-12+,20-15+,25-14-,47-21+/t24-,26+,27+,28+,32-,37-,38+,42+,46-/m0/s1/i1D3,2D3,22D2,23D

Unlabelled CAS Number

89499-17-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat