9-Methoxy Irinotecan Hydrochloride Trihydrate

Analyte Name

9-Methoxy Irinotecan Hydrochloride Trihydrate

Molecular Formula

C34H40N4O7 . (HCl) . 3(H2O)

Molecular Weight

707.22

Accurate Mass

706.3

SMILES

O=C(OC1=CC=C(N=C(C(N2C3)=CC([C@@](O)(CC)C(OC4)=O)=C4C2=O)C3=C5CC)C5=C1OC)N(CC6)CCC6N7CCCCC7.Cl.O.O.O

InChI

InChI=1S/C34H40N4O7.ClH.3H2O/c1-4-21-22-18-38-26(17-24-23(31(38)39)19-44-32(40)34(24,42)5-2)29(22)35-25-9-10-27(30(43-3)28(21)25)45-33(41)37-15-11-20(12-16-37)36-13-7-6-8-14-36;;;;/h9-10,17,20,42H,4-8,11-16,18-19H2,1-3H3;1H;3*1H2/t34-;;;;/m0..../s1

IUPAC

(S)-4,11-diethyl-4-hydroxy-10-methoxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl [1,4'-bipiperidine]-1'-carboxylate hydrochloride trihydrate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat