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Milataxel

Milataxel

Product Description
CAT No.
ALN-P032121
CAS No.
393101-41-2
Mol. F.
C44H55NO16
Mol. Wt.
853.9
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RFQ
Chemical Name : (αR,βR)β-[[(1,1-Dimethylethoxy)carbonyl]amino]-α-hydroxy-2-furanpropanoic acid, (2aR,4S,4aS,6R,9S,11S,12S,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-6,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-4-(1-oxopropoxy)-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl Ester; MAC 321;2-​Furanpropanoic acid, β-​[[(1,​1-​dimethylethoxy)​carbonyl]​amino]​-​α-​hydroxy-​, (2aR,​4S,​4aS,​6R,​9S,​11S,​12S,​12bS)​-​12b-​(acetyloxy)​-​12-​(benzoyloxy)​-​2a,​3,​4,​4a,​5,​6,​9,​10,​11,​12,​12a,​12b-​dodecahydro-​6,​11-​dihydroxy-​4a,​8,​13,​13-​tetramethyl-​5-​oxo-​4-​(1-​oxopropoxy)​-​7,​11-​methano-​1H-​cyclodeca[3,​4]​benz[1,​2-​b]​oxet-​9-​yl ester, (αR,​βR)​-;
Smiles : CC(O[C@@]1([C@@H](C[C@@H]2OC(CC)=O)OC1)[C@@]([C@@]2(C3=O)C)([H])[C@@H]([C@@](C4(C)C)(C[C@H](OC([C@H](O)[C@@H](NC(OC(C)(C)C)=O)C5=CC=CO5)=O)C(C)=C4[C@H]3O)O)OC(C6=CC=CC=C6)=O)=O
Inchi : InChI=1S/C47H59NO14/c1-9-10-13-22-34(52)48(8)36(29-18-14-11-15-19-29)37(53)43(56)60-31-24-47(57)41(61-42(55)30-20-16-12-17-21-30)39-45(7,32(51)23-33-46(39,25-58-33)62-28(4)50)40(54)38(59-27(3)49)35(26(31)2)44(47,5)6/h11-12,14-21,31-33,36-39,41,51,53,57H,9-10,13,22-25H2,1-8H3/t31-,32-,33+,36-,37+,38+,39-,41-,45+,46-,47+/m0/s1

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