2-Methylthio-N-6-Isopentenyladenosine
[CAS# 20859-00-1]

Identification

• Name: 2-Methylthio-N-6-Isopentenyladenosine
• Synonyms: (2R,3S,4R,5R)-2-(Hydroxymethyl)-5-[6-(3-Methylbut-2-Enylamino)-2-Methylsulfanyl-Purin-9-Yl]Tetrahydrofuran-3,4-Diol; (2R,3S,4R,5R)-2-(Hydroxymethyl)-5-[6-(3-Methylbut-2-Enylamino)-2-(Methylthio)-9-Purinyl]Tetrahydrofuran-3,4-Diol; (2R,3R,4S,5R)-2-[6-(3-Methylbut-2-Enylamino)-2-(Methylthio)Purin-9-Yl]-5-Methylol-Tetrahydrofuran-3,4-Diol
• Molecular Formula: C₁₆H₂₃N₅O₄S
• Molecular Weight: 381.45
• CAS Registry Number: 20859-00-1
• SMILES: [C@H]3([N]2C1=C(C(=NC(=N1)SC)NCC=C(C)C)N=C2)[C@@H]([C@H](O)[C@H](O3)CO)O
• InChI: 1S/C16H23N5O4S/c1-8(2)4-5-17-13-10-14(20-16(19-13)26-3)21(7-18-10)15-12(24)11(23)9(6-22)25-15/h4,7,9,11-12,15,22-24H,5-6H2,1-3H3,(H,17,19,20)/t9-,11-,12-,15-/m1/s1
• InChIKey: VZQXUWKZDSEQRR-SDBHATRESA-N