Analyte Name

5'-S-[2-(Hydroxymethyl)phenyl]-5'-thio-adenosine

CAS Number

595609-97-5

Molecular Formula

C17 H19 N5 O4 S

Molecular Weight

389.429

Accurate Mass

389.116

SMILES

Nc1ncnc2c1ncn2[C@@H]3O[C@H](CSc4ccccc4CO)[C@@H](O)[C@H]3O

InChI

InChI=1S/C17H19N5O4S/c18-15-12-16(20-7-19-15)22(8-21-12)17-14(25)13(24)10(26-17)6-27-11-4-2-1-3-9(11)5-23/h1-4,7-8,10,13-14,17,23-25H,5-6H2,(H2,18,19,20)/t10-,13-,14-,17-/m1/s1

IUPAC

(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[[2-(hydroxymethyl)phenyl]sulfanylmethyl]oxolane-3,4-diol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat