Nombre del analito

(3beta,20S)-Pregn-5-ene-3,17,20-triol Sulfate

Número CAS

4080-06-2

Fórmula molecular

C21H34O6S

Peso molecular

414.56

Masa exacta

414.21

SMILES

O[C@H]([C@@]1(O)CC[C@@]([H])([C@@]2(CC=C3C[C@H](CC[C@@]3([C@]2(CC4)[H])C)OS(=O)(O)=O)[H])[C@@]14C)C

InChI

InChI=1S/C21H34O6S/c1-13(22)21(23)11-8-18-16-5-4-14-12-15(27-28(24,25)26)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,13,15-18,22-23H,5-12H2,1-3H3,(H,24,25,26)/t13-,15-,16+,17-,18-,19-,20-,21-/m0/s1

IUPAC

(3S,8R,9S,10R,13S,14S,17R)-17-hydroxy-17-((S)-1-hydroxyethyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl hydrogen sulfate

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat