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3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

PropertiesImage
MNX_IDMNXM147061 Image of MNXM147061
referencechebi:132289
formulaC11H18N2O3S
global charge0
mol weight258.343
InChIKeyOJZAYZYCCIMRRC-UHFFFAOYSA-N
InChIInChI=1S/C11H18N2O3S/c1-2-6-7-5-8(17-4-3-12)9(11(15)16)13(7)10(6)14/h6-9H,2-5,12H2,1H3,(H,15,16)
SMILESCCC1C(=O)N2C1CC(SCCN)C2C(=O)O
MNX internals
InChI (mnx)InChI=1/C11H18N2O3S/c1-2-6-7-5-8(17-4-3-12)9(11(15)16)13(7)10(6)14/h6-9H,2-5,12H2,1H3,(H,15,16)/t6?,7?,8?,9? Image of MNXM147061
SMILES (mnx)[CH3:1][CH2:2][CH:6]1[CH:7]2[CH2:5][CH:8]([S:17][CH2:4][CH2:3][NH2:12])[CH:9]([C:11](=[O:15])[OH:16])[N:13]2[C:10]1=[O:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:132289
chebi:132289
OJZAYZYCCIMRRC-UHFFFAOYSA-N 		3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
3-(2-aminoethylthio)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
carbapenem biosynthesis intermediate 5

seed.compound:cpd31376
seedM:cpd31376
OJZAYZYCCIMRRC-UHFFFAOYSA-N 		C20819
Carbapenem biosynthesis intermediate 5

kegg.compound:C20819
keggC:C20819
OJZAYZYCCIMRRC-UHFFFAOYSA-N 		Carbapenem biosynthesis intermediate 5

keggC:M_C20819
seedM:M_cpd31376 		secondary/obsolete/fantasy identifier