Epothilone B (synthetic)

CAT No.

ALN-P032109

CAS No.

152044-54-7

Mol. F.

C27H41NO6S

Mol. Wt.

507.7

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Product Overview

Technical Data

Reference

RFQ

Product Overview

Chemical Name : (1S,3S,7S,10R,11S,12S,16R)-7,11-Dihydroxy-8,8,10,12,16-pentamethyl-3-[(1E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-4,17-dioxabicyclo[14.1.0]heptadecane-5,9-dione; (-)-Epothilone B; EPO 906; EPO 906A; Epothilone B; Patupilone; (1S,3S,7S,10R,11S,12S,16R)-7,11-dihydroxy-8,8,10,12,16-pentamethyl-3-((E)-1-(2-methylthiazol-4-yl)prop-1-en-2-yl)-4,17-dioxabicyclo[14.1.0]heptadecane-5,9-dione

Smiles : C[C@@]12CCC[C@H](C)[C@H](O)[C@@H](C)C(C(C)(C)[C@@H](O)CC(O[C@H](/C(C)=C/C3=CSC(C)=N3)C[C@@H]1O2)=O)=O

Inchi : InChI=1S/C51H69NO15Si/c1-28-33(63-44(58)39(67-68(13,14)47(7,8)9)37(31-21-17-15-18-22-31)52-45(59)66-46(4,5)6)26-51(60)42(64-43(57)32-23-19-16-20-24-32)40-49(12,34(55)25-35-50(40,27-61-35)65-30(3)54)41(56)38(62-29(2)53)36(28)48(51,10)11/h15-24,33-35,37-40,42,55,60H,25-27H2,1-14H3,(H,52,59)/t33-,34-,35+,37-,38+,39+,40-,42-,49+,50-,51+/m0/s1

Technical Data