1-methyladenosine

Properties Image MNX_ID MNXM4237 reference chebi:16020 formula C11H15N5O4 global charge 0 mol weight 281.272 InChIKey GFYLSDSUCHVORB-IOSLPCCCSA-N InChI InChI=1S/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7-,8-,11-/m1/s1 SMILES CN1C=NC2=C(N=CN2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1=N MNX internals InChI (mnx) InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/b12-9?/t5-,7-,8-,11-/m1/s1 SMILES (mnx) [CH3:1][N:15]1[CH:3]=[N:14][C:10]2=[C:6]([C:9]1=[NH:12])[N:13]=[CH:4][N:16]2[C@H:11]1[C@H:8]([OH:19])[C@H:7]([OH:18])[C@@H:5]([CH2:2][OH:17])[O:20]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0