Nombre del analito

4,10-Desdiacetyl-7,10-dimethyl-4-propionyl Baccatin III

Fórmula molecular

C32 H42 O10

Peso molecular

586.67

Masa exacta

586.278

SMILES

CCC(=O)O[C@@]12CO[C@@H]1C[C@H](OC)[C@]3(C)[C@@H]2[C@H](OC(=O)c4ccccc4)C5(O)C[C@H](O)C(=C([C@@H](OC)C3=O)C5(C)C)C

InChI

InChI=1S/C32H42O10/c1-8-22(34)42-31-16-40-21(31)14-20(38-6)30(5)25(31)27(41-28(36)18-12-10-9-11-13-18)32(37)15-19(33)17(2)23(29(32,3)4)24(39-7)26(30)35/h9-13,19-21,24-25,27,33,37H,8,14-16H2,1-7H3/t19-,20-,21+,24+,25-,27-,30+,31-,32?/m0/s1

IUPAC

[(2S,3R,4S,7R,9S,10S,12R,15S)-1,15-dihydroxy-9,12-dimethoxy-10,14,17,17-tetramethyl-11-oxo-4-propanoyloxy-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