Nombre del analito

25-Hydroxyvitamin D2 3-Hemisuccinate-13C4

Fórmula molecular

13C4 C28 H48 O5

Peso molecular

516.691

Masa exacta

516.364

SMILES

C[C@H](\C=C\[C@H](C)C(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@H](CCC3=C)O[13C](=O)[13CH2][13CH2][13C](=O)O)\CCC[C@]12C

InChI

InChI=1S/C32H48O5/c1-21-10-14-26(37-30(35)18-17-29(33)34)20-25(21)13-12-24-8-7-19-32(6)27(15-16-28(24)32)22(2)9-11-23(3)31(4,5)36/h9,11-13,22-23,26-28,36H,1,7-8,10,14-20H2,2-6H3,(H,33,34)/b11-9+,24-12+,25-13-/t22-,23+,26+,27-,28+,32-/m1/s1/i17+1,18+1,29+1,30+1

IUPAC

4-[(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl]oxy-4-oxo(1,2,3,4-13C4)butanoic acid

Número CAS sin etiquetar

1612177-56-6

Tipo SIL

Carbon

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Stable Isotope Labelled

Formato del producto

Neat