Analyte Name

21-Chloro 6beta-Hydroxy Cortsol

Molecular Formula

C21 H29 Cl O5

Molecular Weight

396.905

Accurate Mass

396.17

SMILES

C[C@]12CCC(=O)C=C1C(O)C[C@H]3[C@@H]4CC[C@](O)(C(=O)CCl)[C@@]4(C)C[C@H](O)[C@H]23

InChI

InChI=1S/C21H29ClO5/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15?,16-,18+,19-,20-,21-/m0/s1

IUPAC

(8S,9S,10R,11S,13S,14S,17R)-17-(2-chloroacetyl)-6,11,17-trihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat