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imipenem hydrate

Properties

Image

Occurences in reactions

MNX_ID

MNXM156763

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₂H₁₉N₃O₅S

charge

mass

317.10454

reference

InChIKey

GSOSVVULSKVSLQ-JJVRHELESA-N

InChI

InChI=1S/C12H17N3O4S.H2O/c1-6(16)9-7-4-8(20-3-2-14-5-13)10(12(18)19)15(7)11(9)17;/h5-7,9,16H,2-4H2,1H3,(H2,13,14)(H,18,19);1H2/t6-,7-,9-;/m1./s1

SMILES

C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(SCCNC=N)C[C@H]12.O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:51799 chebi:51799	imipenem hydrate (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-({2-[(iminomethyl)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid--water (1/1) N-formimidoyl thienamycin monohydrate imipenem
kegg.drug:D00206 keggD:D00206	Imipenem (USP) Imipenem hydrate (JP18)
sabiork.compound:8823 sabiorkM:8823	Imipenem Imipenem anhydrous
keggD:M_D00206	secondary/obsolete/fantasy identifier