methylwyosine

Properties Image MNX_ID MNXM157940 reference metacycM:CPD-15389 formula C15H19N5O5 global charge 0 mol weight 349.347 InChIKey HOEIPINIBKBXTJ-IDTAVKCVSA-N InChI InChI=1S/C15H19N5O5/c1-6-7(2)20-13(24)9-12(18(3)15(20)17-6)19(5-16-9)14-11(23)10(22)8(4-21)25-14/h5,8,10-11,14,21-23H,4H2,1-3H3/t8-,10-,11-,14-/m1/s1 SMILES CC1=C(C)N2C(=O)C3=C(N(C)C2=N1)N([C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C=N3 MNX internals InChI (mnx) InChI=1/C15H19N5O5/c1-6-7(2)20-13(24)9-12(18(3)15(20)17-6)19(5-16-9)14-11(23)10(22)8(4-21)25-14/h5,8,10-11,14,21-23H,4H2,1-3H3/t8-,10-,11-,14-/m1/s1 SMILES (mnx) [CH3:1][C:6]1=[C:7]([CH3:2])[N:20]2[C:13](=[O:24])[C:9]3=[C:12]([N:18]([CH3:3])[C:15]2=[N:17]1)[N:19]([C@H:14]1[C@H:11]([OH:23])[C@H:10]([OH:22])[C@@H:8]([CH2:4][OH:21])[O:25]1)[CH:5]=[N:16]3

Parent-child relations graph

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