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5'-deoxy-5'-(methylsulfinyl)adenosine

PropertiesImage
MNX_IDMNXM115425 Image of MNXM115425
referencechebi:136554
formulaC11H15N5O4S
global charge0
mol weight313.339
InChIKeyWXOJULRVRHWMGT-JLQSGANNSA-N
InChIInChI=1S/C11H15N5O4S/c1-21(19)2-5-7(17)8(18)11(20-5)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-,21?/m1/s1
SMILESCS(=O)C[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C11H15N5O4S/c1-21(19)2-5-7(17)8(18)11(20-5)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-,21?/m1/s1 Image of MNXM115425
SMILES (mnx)[CH3:1][S:21]([CH2:2][C@@H:5]1[C@@H:7]([OH:17])[C@@H:8]([OH:18])[C@H:11]([N:16]2[CH:4]=[N:15][C:6]3=[C:9]([NH2:12])[N:13]=[CH:3][N:14]=[C:10]32)[O:20]1)=[O:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:136554
chebi:136554
WXOJULRVRHWMGT-JLQSGANNSA-N 		5'-deoxy-5'-(methylsulfinyl)adenosine
5'-Deoxy-5'-S-adenosylmethyl sulfoxide
5'-deoxy-5'-(methanesulfinyl)adenosine
5'-deoxy-5'-(methanesulphinyl)adenosine
5'-deoxy-5'-methylsulfinyladenosine
Methylthioadenosine sulfoxide
hmdb:HMDB0033662
WXOJULRVRHWMGT-UHFFFAOYSA-N 		(S)-5'-Deoxy-5'-(methylsulfinyl)adenosine
(R)-5'-Deoxy-5'-(methylsulphinyl)adenosine
(S)-5'-Deoxy-5'-(methylsulphinyl)adenosine
2-(6-Amino-9H-purin-9-yl)-5-(methanesulphinylmethyl)oxolane-3,4-diol
2-(6-amino-9H-purin-9-yl)-5-(methanesulfinylmethyl)oxolane-3,4-diol
2-(6-aminopurin-9-yl)-5-(methanesulfinylmethyl)oxolane-3,4-diol
5'-Deoxy-5'-(methylsulfinyl)adenosine, 9ci

CHEBI:172121
chebi:172121
WXOJULRVRHWMGT-UHFFFAOYSA-N 		(S)-5'-Deoxy-5'-(methylsulfinyl)adenosine
2-(6-aminopurin-9-yl)-5-(methylsulinylmethyl)oxolane-3,4-diol

hmdb:HMDB33662 		secondary/obsolete/fantasy identifier