nocardicin A

Chemical Formula:

C₂₃H₂₃N₄O₉

Molecular Weight:

499.456 Daltons

Monoisotopic Mass:

501.16215342220005 Daltons

SMILES:

C3(C(NC(=O)C(C1(=CC=C(OCCC([N+])C(=O)[O-])C=C1))=NO)C(=O)N(C(C2(=CC=C(O)C=C2))C(=O)[O-])3)

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-/m1/s1

InChIKey:

CTNZOGJNVIFEBA-TWTPMLPMSA-M

Synonyms

(2R)-2-amino-4-{4-[(1E)-{[(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl]carbamoyl}(hydroxyimino)methyl]phenoxy}butanoate

Databases

MetaCyc: NOCARDICIN-A

PubChem (CID): 122706496

ChEBI: 58244

KEGG: C01941

CAS: 39391-39-4