Nombre del analito

6-Hydroxy-7-epi Docetaxel

Fórmula molecular

C43 H53 N O15

Peso molecular

823.879

Masa exacta

823.342

SMILES

CC(=O)O[C@@]12COC1[C@@H](O)[C@@H](O)[C@]3(C)[C@@H]2[C@H](OC(=O)c4ccccc4)[C@]5(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c6ccccc6)C(=C([C@@H](O)C3=O)C5(C)C)C

InChI

InChI=1S/C43H53NO15/c1-21-25(56-37(52)29(47)27(23-15-11-9-12-16-23)44-38(53)59-39(3,4)5)19-43(54)35(57-36(51)24-17-13-10-14-18-24)31-41(8,32(49)28(46)26(21)40(43,6)7)33(50)30(48)34-42(31,20-55-34)58-22(2)45/h9-18,25,27-31,33-35,46-48,50,54H,19-20H2,1-8H3,(H,44,53)/t25-,27-,28+,29+,30-,31-,33+,34?,35-,41+,42+,43+/m0/s1

IUPAC

[(1S,2S,3R,4S,8S,9S,10S,12R,15S)-4-acetyloxy-1,8,9,12-tetrahydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat