loader
Please Wait
Applying Filters...

EuroAPI Header EuroAPI Header

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about Sulacillin, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    Sulacillin

    APIs // Active Pharmaceutical Ingredients

    DOSSIERs // Finished Dosage Forms

    PharmaCompass

    With Fermion, start the journey of your innovative API.

    Seqens is an integrated global leader in pharmaceutical solutions & specialty ingredients & provides custom-made solutions.

    2D Structure
    1. Also known as: 94935-63-4, Ampicillin mixture with sulbactam, Sulacillin, Ampicillin-sulbactam, (2s,5r,6r)-6-[[(2r)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;(1r,4s)-3,3-dimethyl-2,2,6-trioxo-2lambda6-thiabicyclo[3.2.0]heptane-4-carboxylic acid, Sulbactam-ampicillin mixt. (1:2)
    Molecular Formula
    C25H31N3O9S2
    Molecular Weight
    581.7  g/mol
    InChI Key
    KMEGBUCIGMEPME-LQYKFRDPSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;(1R,4S)-3,3-dimethyl-2,2,6-trioxo-26-thiabicyclo[3.2.0]heptane-4-carboxylic acid
    2.1.2 InChI
    InChI=1S/C16H19N3O4S.C9H12O5S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;1-9(2)7(8(11)12)6-4(10)3-5(6)15(9,13)14/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);5-7H,3H2,1-2H3,(H,11,12)/t9-,10-,11+,14-;5-,6?,7+/m11/s1
    2.1.3 InChI Key
    KMEGBUCIGMEPME-LQYKFRDPSA-N
    2.1.4 Canonical SMILES
    CC1(C(C2C(S1(=O)=O)CC2=O)C(=O)O)C.CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C
    2.1.5 Isomeric SMILES
    CC1([C@@H](C2[C@H](S1(=O)=O)CC2=O)C(=O)O)C.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)C
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Sulacillin

    2.2.2 Depositor-Supplied Synonyms

    1. 94935-63-4

    2. Ampicillin Mixture With Sulbactam

    3. Sulacillin

    4. Ampicillin-sulbactam

    5. (2s,5r,6r)-6-[[(2r)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid;(1r,4s)-3,3-dimethyl-2,2,6-trioxo-2lambda6-thiabicyclo[3.2.0]heptane-4-carboxylic Acid

    6. Sulbactam-ampicillin Mixt. (1:2)

    7. Ampicillin-sulbactam Mixt.

    8. Ampicillin And Sulbactam

    9. Dtxsid60241694

    10. 4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid, 6-(((2r)-aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2s,5r,6r)-, Mixt. With (2s,5r)-3,3-dimethyl-7-oxo-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid 4,4-dioxide

    11. 4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid, 6-((aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2s-(2-alpha,5-alpha,6-beta(s*)))-, Mixt. With (2s-cis)-3,3-dimethyl-7-oxo-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid 4,4-dioxide

    2.3 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 581.7 g/mol
    Molecular Formula C25H31N3O9S2
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count11
    Rotatable Bond Count5
    Exact Mass581.15017192 g/mol
    Monoisotopic Mass581.15017192 g/mol
    Topological Polar Surface Area235 Ų
    Heavy Atom Count39
    Formal Charge0
    Complexity1000
    Isotope Atom Count0
    Defined Atom Stereocenter Count6
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 FDA Pharmacological Classification
    4.1.1 Pharmacological Classes
    Penicillins [CS]; beta Lactamase Inhibitor [EPC]; beta Lactamase Inhibitors [MoA]; Penicillin-class Antibacterial [EPC]
    Post Enquiry
    POST ENQUIRY