Analyte Name

Vincristine Methiodide

CAS Number

4724-00-9

Molecular Formula

C47H59IN4O10

Molecular Weight

966.91

Accurate Mass

966.33

SMILES

[I-].O=CN1C2=CC(OC)=C(C=C2C34CCN5CC=CC(CC)(C(OC(=O)C)C(O)(C(=O)OC)C13)C54)C6(C(=O)OC)C=7NC=8C=CC=CC8C7CC[N+]9(C)CC(C6)CC(O)(CC)C9

InChI

InChI=1S/C47H59N4O10.HI/c1-8-43(56)23-29-24-46(41(54)59-6,37-31(15-20-51(4,25-29)26-43)30-13-10-11-14-34(30)48-37)33-21-32-35(22-36(33)58-5)50(27-52)39-45(32)17-19-49-18-12-16-44(9-2,38(45)49)40(61-28(3)53)47(39,57)42(55)60-7;/h10-14,16,21-22,27,29,38-40,48,56-57H,8-9,15,17-20,23-26H2,1-7H3;1H/q+1;/p-1

IUPAC

(3R,5S,7S,9S)-9-((3aR,3a1R,4R,5S,5aR,10bR)-4-acetoxy-3a-ethyl-6-formyl-5-hydroxy-8-methoxy-5-(methoxycarbonyl)-3a,3a1,4,5,5a,6,11,12-octahydro-1H-indolizino[8,1-cd]carbazol-9-yl)-5-ethyl-5-hydroxy-9-(methoxycarbonyl)-3-methyl-1,2,3,4,5,6,7,8,9,10-decahydro-3,7-methano[1]azacycloundecino[5,4-b]indol-3-ium iodide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat