Nombre del analito

4-Methyl trans-Doxercalciferol

Número CAS

1818286-63-3

Fórmula molecular

C28 H44 O2

Peso molecular

412.648

Masa exacta

412.334

SMILES

CC(C)[C@H](C)\C=C\C(C)C1CCC2C(=CCC[C@@]12C)\C=C/C3=C(C)[C@H](O)CC(O)C3

InChI

InChI=1S/C28H44O2/c1-18(2)19(3)9-10-20(4)25-13-14-26-22(8-7-15-28(25,26)6)11-12-23-16-24(29)17-27(30)21(23)5/h8-12,18-20,24-27,29-30H,7,13-17H2,1-6H3/b10-9+,12-11-/t19-,20?,24?,25?,26?,27-,28+/m1/s1

IUPAC

(3R)-5-[(Z)-2-[(7aS)-1-[(E,5S)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-4-ene-1,3-diol

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Impurity

Formato del producto

Neat