Nome dell'analita

7-Oxo Docetaxel

Formula molecolare

C43H51NO14

Peso molecolare

805.87

Massa accurata

805.33

SMILES

O[C@H](C1=C(C)[C@@H](OC([C@H](O)[C@H](C2=CC=CC=C2)NC(OC(C)(C)C)=O)=O)C[C@]([C@@H](OC(C3=CC=CC=C3)=O)[C@@]([C@@]4(OC(C)=O)C(OC4)C5)([H])[C@@]6(C)C5=O)(O)C1(C)C)C6=O

InChI

InChI=1S/C43H51NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26,28,30-33,35,47-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,28?,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1

IUPAC

(4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-6,11-dihydroxy-4a,8,13,13-tetramethyl-4,5-dioxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl benzoate

Temperatura di conservazione

-20°C

Temperatura di spedizione

Room Temperature

Paese di origine

CANADA

Formato del prodotto

Neat