(6S,7R,8R)-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one

Properties Image MNX_ID MNXM173194 reference chebi:128962 formula C24H25N3O3 global charge 0 mol weight 403.482 InChIKey GFTMAWDXPFZQQI-FUPPJEDESA-N InChI InChI=1S/C24H25N3O3/c1-2-3-4-6-17-8-10-18(11-9-17)23-20-14-26(15-22(29)27(20)21(23)16-28)24(30)19-7-5-12-25-13-19/h5,7-13,20-21,23,28H,2-3,14-16H2,1H3/t20-,21+,23-/m1/s1 SMILES CCCC#CC1=CC=C([C@@H]2[C@H]3CN(C(=O)C4=CN=CC=C4)CC(=O)N3[C@H]2CO)C=C1 MNX internals InChI (mnx) InChI=1/C24H25N3O3/c1-2-3-4-6-17-8-10-18(11-9-17)23-20-14-26(15-22(29)27(20)21(23)16-28)24(30)19-7-5-12-25-13-19/h5,7-13,20-21,23,28H,2-3,14-16H2,1H3/t20-,21+,23-/m1/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][C:4]#[C:6][C:17]1=[CH:9][CH:11]=[C:18]([C@@H:23]2[C@H:20]3[CH2:14][N:26]([C:24]([C:19]4=[CH:13][N:25]=[CH:12][CH:5]=[CH:7]4)=[O:30])[CH2:15][C:22](=[O:29])[N:27]3[C@H:21]2[CH2:16][OH:28])[CH:10]=[CH:8]1

Parent-child relations graph

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