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Sulopenem 50mg

CAT: 0628-A22051-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0628-A22051-50Size:50 mg
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CAS Number
120788-07-0

Chemical Information

Sulopenem

Sulopenem is a penem antibacterial. It is marketed as the prodrug [sulopenem etzadroxil] in combination with [probenecid].

CAS Number120788-07-0
PubChem CID9950244
IUPAC Name(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(1R,3S)-1-oxothiolan-3-yl]sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Molecular FormulaC12H15NO5S3
Molecular Weight349.5
XLogP0
Topological Polar Surface Area165
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity563
SMILES
C[C@H]([C@@H]1[C@@H]2N(C1=O)C(=C(S2)S[C@H]3CC[S@@](=O)C3)C(=O)O)O
InChI
InChI=1S/C12H15NO5S3/c1-5(14)7-9(15)13-8(11(16)17)12(20-10(7)13)19-6-2-3-21(18)4-6/h5-7,10,14H,2-4H2,1H3,(H,16,17)/t5-,6+,7+,10-,21-/m1/s1
InChIKey
FLSUCZWOEMTFAQ-PRBGKLEPSA-N
Chemical Structure
2D Structure
2D structure of Sulopenem
CAS: 120788-07-0
CID: 9950244
Formula: C12H15NO5S3
MW: 349.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight349.5
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass349.01123610
Monoisotopic Mass349.01123610
Topological Polar Surface Area165 Ų
Heavy Atom Count21
Formal Charge0
Complexity563
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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