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7-O-(Trifluoroacetyl) Baccatin III

7-O-(Trifluoroacetyl) Baccatin III

Product Description
CAT No.
ALN-P032138
CAS No.
158811-19-9
Mol. F.
C32H37F3O13S
Mol. Wt.
718.7
Stock
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RFQ
Chemical Name : Trifluoro-methanesulfonic Acid (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-bis(Acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-9,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-4-yl Ester;Baccatin III 7-triflate
Smiles : CC(O[C@@]1([C@@H](C[C@@H]2OS(=O)(C(F)(F)F)=O)OC1)[C@@]([C@@]2(C3=O)C)([H])[C@@H]([C@@](C4(C)C)(C[C@H](O)C(C)=C4[C@H]3OC(C)=O)O)OC(C5=CC=CC=C5)=O)=O
Inchi : InChI=1S/C52H75NO13Si2/c1-15-68(16-2,17-3)65-38-28-37(56)51(64-33(6)55)30-61-45-43(51)50(38,12)44(57)41(62-32(5)54)39-31(4)36(29-52(45,60)49(39,10)11)63-47(59)42(66-67(13,14)48(7,8)9)40(34-24-20-18-21-25-34)53-46(58)35-26-22-19-23-27-35/h18-27,36-38,40-43,45,56,60H,15-17,28-30H2,1-14H3,(H,53,58)/t36-,37+,38-,40-,41+,42+,43-,45-,50+,51-,52+/m0/s1
Synonym : Baccatin III 7-O-Triflate

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