CAS Number
Molecular Formula
C80H115NO22
Product format
Neat
Molecular Weight
1442.79
Shipping
Room Temperature
API Family
Synonyms
Eribulin Dimer Impurity; 2408645-13-4
Iupac Name
(1S, 3S, 6S, 9S, 12S, 14R, 16R, 18S, 20R, 21R, 22S, 26R, 29S, 31R, 32S, 33R, 35R, 36S)-20-[(2S)-2-hydroxy-3-[[(2S)-2-hydroxy-3-[(1S, 3S, 6S, 9S, 12S, 14R, 16R, 18S, 20R, 21R, 22S, 26R, 29S, 31R, 32S, 33R, 35R, 36S)-21-methoxy-14-methyl-8, 15-dimethylidene-24-oxo-2, 19, 30, 34, 37, 39, 40, 41-octaoxanonacyclo[24.9.2.13, 32.13, 33.16, 9.112, 16.018, 22.029, 36.031, 35]hentetracontan-20-yl]propyl]amino]propyl]-21-methoxy-14-methyl-8, 15-dimethylidene-2, 19, 30, 34, 37, 39, 40, 41-octaoxanonacyclo[24.9.2.13, 32.13, 33.16, 9.112, 16.018, 22.029, 36.031 and 35]hentetracontan-24-one
InChI
InChI=1S/C80H115NO22/c1-37-21-47-9-13-55-39(3)23-51(88-55)17-19-79-33-65-71(100-79)73-75(98-65)77(102-79)69-57(96-73)15-11-49(92-69)25-43(82)27-53-61(31-59(90-47)41(37)5)94-63(67(53)86-7)29-45(84)35-81-36-46(85)30-64-68(87-8)54-28-44(83)26-50-12-16-58-70(93-50)78-76-74(97-58)72-66(99-76)34-80(101-72,103-78)20-18-52-24-40(4)56(89-52)14-10-48-22-38(2)42(6)60(91-48)32-62(54)95-64/h37-38,45-78,81,84-85H,3-6,9-36H2,1-2,7-8H3/t37-,38-,45+,46+,47+,48+,49-,50-,51+,52+,53+,54+,55+,56+,57+,58+,59-,60-,61+,62+,63-,64-,65-,66-,67-,68-,69+,70+,71+,72+,73+,74+,75-,76-,77+,78+,79+,80+/m1/s1
