Nombre del analito

Estradiol Mustard

Número CAS

22966-79-6

Fórmula molecular

C42 H50 Cl4 N2 O4

Peso molecular

788.669

Masa exacta

786.252

SMILES

C[C@]12CC[C@H]3[C@@H](CCc4cc(OC(=O)Cc5ccc(cc5)N(CCCl)CCCl)ccc34)[C@@H]1CC[C@@H]2OC(=O)Cc6ccc(cc6)N(CCCl)CCCl

InChI

InChI=1S/C42H50Cl4N2O4/c1-42-17-16-36-35-13-11-34(51-40(49)26-29-2-7-32(8-3-29)47(22-18-43)23-19-44)28-31(35)6-12-37(36)38(42)14-15-39(42)52-41(50)27-30-4-9-33(10-5-30)48(24-20-45)25-21-46/h2-5,7-11,13,28,36-39H,6,12,14-27H2,1H3/t36-,37-,38+,39+,42+/m1/s1

IUPAC

[(8R,9S,13S,14S,17S)-17-[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Bioactive Small Molecule

Formato del producto

Neat