**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

isonocardicin A

Properties Image MNX_ID MNXM732873 reference metacycM:ISONOCARDICIN-A formula C23H23N4O9 global charge -1 mol weight 499.456 InChIKey CTNZOGJNVIFEBA-ASIAWSIFSA-M InChI InChI=1S/C23H24N4O9/c24-16(22(31)32)9-10-36-15-7-3-12(4-8-15)18(26-35)20(29)25-17-11-27(21(17)30)19(23(33)34)13-1-5-14(28)6-2-13/h1-8,16-17,19,28,35H,9-11,24H2,(H,25,29)(H,31,32)(H,33,34)/p-1/b26-18+/t16-,17-,19+/m0/s1 SMILES [NH3+][C@@H](CCOc1ccc(/C(=N\O)C(=O)N[C@H]2CN([C@@H](C(=O)[O-])c3ccc(O)cc3)C2=O)cc1)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C23H24N4O9/c24-16(22(31)32)9-10-36-15-7-3-12(4-8-15)18(26-35)20(29)25-17-11-27(21(17)30)19(23(33)34)13-1-5-14(28)6-2-13/h1-8,16-17,19,28,35H,9-11,24H2,(H,25,29)(H,31,32)(H,33,34)/b26-18+/t16-,17-,19+/m0/s1 SMILES (mnx) [cH:1]1[cH:5][c:14]([OH:28])[cH:6][cH:2][c:13]1[C@H:19]([C:23]([OH:33])=[O:34])[N:27]1[CH2:11][C@H:17]([NH:25][C:20](/[C:18]([c:12]2[cH:3][cH:7][c:15]([O:36][CH2:10][CH2:9][C@@H:16]([C:22]([OH:31])=[O:32])[NH2:24])[cH:8][cH:4]2)=[N:26]/[OH:35])=[O:29])[C:21]1=[O:30]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:ISONOCARDICIN-A metacycM:ISONOCARDICIN-A CTNZOGJNVIFEBA-ASIAWSIFSA-M	isonocardicin A (2S)-2-amino-4-{4-[(1E)-{[(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl]carbamoyl}(hydroxyimino)methyl]phenoxy}butanoate 1-azetidineacetic acid