(-)-rolipram

Properties Image MNX_ID MNXM30344 reference chebi:40133 formula C16H21NO3 global charge 0 mol weight 275.348 InChIKey HJORMJIFDVBMOB-LBPRGKRZSA-N InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1 SMILES COC1=C(OC2CCCC2)C=C([C@@H]2CNC(=O)C2)C=C1 MNX internals InChI (mnx) InChI=1/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1 SMILES (mnx) [CH3:1][O:19][C:14]1=[C:15]([O:20][CH:13]2[CH2:4][CH2:2][CH2:3][CH2:5]2)[CH:8]=[C:11]([C@H:12]2[CH2:9][C:16]([OH:18])=[N:17][CH2:10]2)[CH:6]=[CH:7]1

Parent-child relations graph

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