(2S,3S,3aR,9bR)-3-(hydroxymethyl)-1-(2-methoxy-1-oxoethyl)-6-oxo-N-(phenylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

Properties Image MNX_ID MNXM171633 reference chebi:101597 formula C22H25N3O5 global charge 0 mol weight 411.458 InChIKey DTBBLQRMWRNBOL-AFMUBRCDSA-N InChI InChI=1S/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m0/s1 SMILES COCC(=O)N1[C@H](C(=O)NCC2=CC=CC=C2)[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]21 MNX internals InChI (mnx) InChI=1/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m0/s1 SMILES (mnx) [CH3:1][O:30][CH2:13][C:19]([N:25]1[C@@H:20]2[C@@H:15]([CH2:11][N:24]3[C:17]2=[CH:8][CH:5]=[CH:9][C:18]3=[O:27])[C@H:16]([CH2:12][OH:26])[C@H:21]1[C:22](=[N:23][CH2:10][C:14]1=[CH:6][CH:3]=[CH:2][CH:4]=[CH:7]1)[OH:29])=[O:28]

Parent-child relations graph

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