Eribulin Impurity 3

CAT No.

ALN-E065004

CAS No.

1534341-96-2

Mol. F.

C40H61NO12

Mol. Wt.

747.9

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Product Overview

Technical Data

Reference

RFQ

Product Overview

Chemical Name : 7,11:10,14:13,16:21,24:27,31-Pentoepoxy-2H-cyclohentriaconta[b]furan-5,18(3H,4H)-dione,2-[(2S)-3-amino-2-hydroxypropyl]octacosahydro-12,15-dihydroxy-3-methoxy-29-methyl-23,30-bis(methylene)-,(2R,3R,3aS,7R,10S,11R,12S,13S,14S,15S,16R,21S,24S,27S,29R,31R,32aS)-

Smiles : CO[C@@H]([C@@H](C[C@@H](CN)O)O1)[C@@H](CC(CC2CC[C@@]3([H])[C@]([C@H](O)[C@H]4[C@@]([C@@H](O)[C@]([H])(O4)CC5=O)([H])O3)([H])O2)=O)[C@@H]1C[C@@H](O[C@@H](CC[C@H]6C(C[C@H](CC5)O6)=C)C[C@H]7C)C7=C

Inchi : InChI=1S/C40H58O12/c1-19-11-24-5-7-28-20(2)12-26(45-28)9-10-40-17-33-36(51-40)37-38(50-33)39(52-40)35-29(49-37)8-6-25(47-35)13-22(42)14-27-31(16-30(46-24)21(19)3)48-32(34(27)44-4)15-23(43)18-41/h19,23-39,41,43H,2-3,5-18H2,1,4H3/t19-,23+,24+,25?,26+,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39+,40+/m1/s1

Technical Data