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    Chemistry

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    Also known as: Schembl193928
    Molecular Formula
    C22H20N4NaO8S2+
    Molecular Weight
    555.5  g/mol
    InChI Key
    REACMANCWHKJSM-WXNNVNCASA-N
    Cefsulodin
    1 2D Structure

    Cefsulodin

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;(6R,7R)-3-[(4-carbamoylpyridin-1-ium-1-yl)methyl]-8-oxo-7-[(2-phenyl-2-sulfoacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
    2.1.2 InChI
    InChI=1S/C22H20N4O8S2.Na/c23-18(27)13-6-8-25(9-7-13)10-14-11-35-21-15(20(29)26(21)16(14)22(30)31)24-19(28)17(36(32,33)34)12-4-2-1-3-5-12;/h1-9,15,17,21H,10-11H2,(H4-,23,24,27,28,30,31,32,33,34);/q;+1/t15-,17?,21-;/m1./s1
    2.1.3 InChI Key
    REACMANCWHKJSM-WXNNVNCASA-N
    2.1.4 Canonical SMILES
    C1C(=C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)C(=O)[O-])C[N+]4=CC=C(C=C4)C(=O)N.[Na+]
    2.1.5 Isomeric SMILES
    C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)C(=O)[O-])C[N+]4=CC=C(C=C4)C(=O)N.[Na+]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Schembl193928

    2.3 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 555.5 g/mol
    Molecular Formula C22H20N4NaO8S2+
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count9
    Rotatable Bond Count8
    Exact Mass555.06202524 g/mol
    Monoisotopic Mass555.06202524 g/mol
    Topological Polar Surface Area225 Ų
    Heavy Atom Count37
    Formal Charge1
    Complexity1070
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

    API Reference Price

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    [{"dataSource":"API Export","activeIngredients":"","year":"2023","qtr":"Q3","strtotime":1692556200,"product":"CEFSULODIN SODIUM","address":"PLOT NO.2 MAITRIVIHARBEHIND MAI TRIVANAM AMEERPET","city":"Hyderabad","supplier":"AUROBINDO PHARMA LIMITED","supplierCountry":"INDIA","foreign_port":"NA","customer":"IDEXX DISTRIBUTION INC","customerCountry":"UNITED STATES OF AMERICA","quantity":"7.00","actualQuantity":"7","unit":"KGS","unitRateFc":"12504.3","totalValueFC":"86858","currency":"USD","unitRateINR":1027857.1472857144,"date":"21-Aug-2023","totalValueINR":"7195000.031","totalValueInUsd":"86858","indian_port":"HYDERABAD ICD","hs_no":"29419090","bill_no":"0","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES OF AMERICA","selfForZScoreResived":"Pharma Grade","supplierPort":"HYDERABAD ICD","supplierAddress":"PLOT NO.2 MAITRIVIHARBEHIND MAI TRIVANAM AMEERPET, Hyderabad","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2023","qtr":"Q3","strtotime":1692556200,"product":"CEFSULODIN SODIUM","address":"PLOT NO.2 MAITRIVIHARBEHIND MAI TRIVANAM AMEERPET","city":"Hyderabad","supplier":"AUROBINDO PHARMA LIMITED","supplierCountry":"INDIA","foreign_port":"NA","customer":"IDEXX DISTRIBUTION INC","customerCountry":"UNITED STATES OF AMERICA","quantity":"30.00","actualQuantity":"30","unit":"KGS","unitRateFc":"13947.7","totalValueFC":"415216.4","currency":"USD","unitRateINR":1146500.0003333332,"date":"21-Aug-2023","totalValueINR":"34395000.01","totalValueInUsd":"415216.4","indian_port":"HYDERABAD ICD","hs_no":"29419090","bill_no":"0","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES OF AMERICA","selfForZScoreResived":"Pharma Grade","supplierPort":"HYDERABAD ICD","supplierAddress":"PLOT NO.2 MAITRIVIHARBEHIND MAI TRIVANAM AMEERPET, Hyderabad","customerAddress":""}]
    21-Aug-2023
    21-Aug-2023
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