Analyte Name

N-Desisobutyl-N-propyl Rifabutin

CAS Number

75903-10-5

Molecular Formula

C45 H60 N4 O11

Molecular Weight

832.978

Accurate Mass

832.426

SMILES

CCCN1CCC2(CC1)NC3=C4NC(=O)C(=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(=O)C)C(C)C(OC)C=COC5(C)Oc6c(C)c(O)c(C4=O)c(C3=N2)c6C5=O)C

InChI

InChI=1S/C45H60N4O11/c1-11-18-49-19-16-45(17-20-49)47-33-30-31-38(53)27(7)41-32(30)42(55)44(9,60-41)58-21-15-29(57-10)24(4)40(59-28(8)50)26(6)37(52)25(5)36(51)22(2)13-12-14-23(3)43(56)46-35(39(31)54)34(33)48-45/h12-15,21-22,24-26,29,36-37,40,48,51-53H,11,16-20H2,1-10H3,(H,46,56)

IUPAC

(2,15,17-trihydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23,32-trioxo-1'-propylspiro[8,33-dioxa-24,27,29-triazapentacyclo[23.6.1.14,7.05,31.026,30]tritriaconta-1,3,5(31),9,19,21,25,29-octaene-28,4'-piperidine]-13-yl) acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat