5'-S-Methyl-5'-thioadenosine

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Systematic / IUPAC Name: 9-(5-S-Methyl-5-thiopentofuranosyl)-9H-purin-6-amine

ID: Reference253

Other Names: Methylthioadenosine;
5-Methylthioadenosine;
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-((methylthio)methyl)tetrahydrofuran-3,4-diol;
S-Methyl-5-thioadenosine;
Adenosine, 5-methylthio- ; more

Formula: C11H15N5O3S

Class: Endogenous Metabolites

Spectral Data

5'-S-Methyl-5'-thioadenosine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 261
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 12/1/2014 3:30:32 PM
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Identificators

InChI InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1
InChI Key WUUGFSXJNOTRMR-IOSLPCCCSA-N
Canonical SMILES n2c1c(ncnc1n(c2)C3OC(C(O)C3O)CSC)N
CAS 2457809
Splash
Other Names Methylthioadenosine;
5-Methylthioadenosine;
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-((methylthio)methyl)tetrahydrofuran-3,4-diol;
S-Methyl-5-thioadenosine;
Adenosine, 5-methylthio-;
(2R,3R,4S,5R)-2-(6-Aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol;
9-(5-S-Methyl-5-thio-β-D-ribofuranosyl)-9H-purin-6-amine;
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-[(methylsulfanyl)methyl]oxolane-3,4-diol;
1-(6-Amino-9H-purin-9-yl)-1-deoxy-5-S-methyl-5-thio-β-δ-ribofuranose;
β-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-S-methyl-5-thio-;
Vitamin L2;
MTA

In Other Databases

HMDb HMDB01173
ChemSpider 388321
PubChem 439176
ChEBI CHEBI:17509
ChEMBL CHEMBL277041
KEGG C00170