S-(((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl-13C5)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)-L-homocysteine

Analyte Name

S-(5'-Adenosyl)-L-homocysteine-13C5 (Purine-13C5)

Molecular Formula

C9 13C5 H20 N6 O5 S

Molecular Weight

389.374

Accurate Mass

389.1384

SMILES

N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2[13cH]n[13c]3[13c](N)n[13cH]n[13c]23)C(=O)O

InChI

InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1/i4+1,5+1,8+1,11+1,12+1

IUPAC

(2S)-2-amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylsulfanyl]butanoic acid

Unlabelled CAS Number

979-92-0

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat