Nombre del analito

3-O-Benzyl 17alpha-Estradiol 17-O-(4-Nitrobenzoate)

Número CAS

229486-10-6

Fórmula molecular

C32H33NO5

Peso molecular

511.61

Masa exacta

511.2359

SMILES

C[C@]12CC[C@H]3[C@@H](CCc4cc(OCc5ccccc5)ccc34)[C@@H]1CC[C@@H]2OC(=O)c6ccc(cc6)[N+](=O)[O-]

InChI

InChI=1S/C32H33NO5/c1-32-18-17-27-26-14-12-25(37-20-21-5-3-2-4-6-21)19-23(26)9-13-28(27)29(32)15-16-30(32)38-31(34)22-7-10-24(11-8-22)33(35)36/h2-8,10-12,14,19,27-30H,9,13,15-18,20H2,1H3/t27-,28-,29+,30+,32+/m1/s1

IUPAC

[(8R,9S,13S,14S,17S)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 4-nitrobenzoate

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat