Cas no 56092-81-0 (Ionomycin)

Ionomycin structure
Ionomycin structure
Product Name:Ionomycin
CAS No:56092-81-0
MF:C41H72O9
MW:709.004994392395
MDL:MFCD06798385
CID:368625
PubChem ID:24896159
Update Time:2025-04-19

Ionomycin Chemical and Physical Properties

Names and Identifiers

    • 10,16-Docosadienoicacid,11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-,(4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-
    • 10,16-Docosadienoicacid,11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-,(4R,6S,8S,10Z,12R,14R,16E,18R,
    • Ionomycin
    • Ionomycin (free acid)
    • Ionomycin free acid
    • Ionomycin free acid,(4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl
    • Ionomycin free acid,(4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-10,16-docosadienoicacid
    • Ionomycin from Streptomyces conglobatus
    • Ionomycin,Free Acid,from Streptomyces conglbatus
    • Ionomycin,Free Acid,Streptomyces conglobatus
    • IONOMYCIN,STREPTOMYCES CONGLOBATUS
    • Ionomycinefreeacid
    • [2S-[2alpha[2'S*,5'R*(S*)],5beta(4S*,6R*,8R*,10Z,12S*,14S*,16E,18S*,19S*,20R*,21R*)]]-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[octahydro-5'-(1-hydroxyethyl)-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-10,16-docosadienoic acid
    • 54V905V6AT
    • C41H72O9
    • SQ23377
    • NS00011830
    • AS-56129
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-22-((2S,2'R,5S,5'S)-5'-((R)-1-hydroxyethyl)-2,5'-dimethyloctahydro-[2,2'-bifuran]-5-yl)-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoicacid
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-22-((2S,2'R,5S,5'S)-5'-((R)-1-hydroxyethyl)-2,5'-dimethyloctahydro-[2,2'-bifuran]-5-yl)-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoic acid
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-trihydroxy-22-[(2S,5S)-5-[(2R,5S)-5-[(1R)-1-hydroxyethyl]-5-methyloxolan-2-yl]-5-methyloxolan-2-yl]-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoic acid
    • SQ-23377
    • CS-0006887
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-10,16-docosadienoic acid
    • HY-13434
    • CHEMBL501617
    • SCHEMBL17265597
    • MFCD06798385
    • AKOS024456942
    • HMS3403I13
    • Ionomycin from Streptomyces conglobatus, >=98% (HPLC)
    • Ionomycin, Free Acid, Streptomyces conglobatus
    • SQ 23377
    • AKOS037645010
    • Ionomycin Free Acid (85%)
    • DTXSID2040521
    • HSCI1_000207
    • 56092-81-0
    • HB1002
    • CHEBI:63954
    • UNII-54V905V6AT
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-trihydroxy-22-{(2S,2'R,5S,5'S)-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyloctahydro-2,2'-bifuran-5-yl}-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoic acid
    • 10,16-Docosadienoic acid, 11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-, (4R,6S,8S,10Z,12R,14R,16E,1 8R,19R,20S,21S)-
    • PGHMRUGBZOYCAA-ADZNBVRBSA-N
    • 10,16-DOCOSADIENOIC ACID, 11,19,21-TRIHYDROXY-4,6,8,12,14,18,20-HEPTAMETHYL-22-((2S,2'R,5S,5'S)-OCTAHYDRO-5'-((1R)-1-HYDROXYETHYL)-2,5'-DIMETHYL(2,2'-BIFURAN)-5-YL)-9-OXO-, (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-
    • EX-A8018F
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-trihydroxy-22-((2S,2'R,5S,5'S)-5'-((1R)-1-hydroxyethyl)-2,5'-dimethyloctahydro-2,2'-bifuran-5-yl)-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoic acid
    • DTXCID0020521
    • DA-64472
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21trihydroxy22((2S,5S)5((2R,5S)5((1R)1 hydroxyethyl)5methyloxolan2yl)5methyloxolan2-yl) 4,6,8,12,14,18, 20 heptamethyl-9-oxodocosa-10,16-dienoate
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21trihydroxy22[(2S,5S)5[(2R,5S)5[(1R)1 hydroxyethyl]5methyloxolan2yl]5methyloxolan2-yl] 4,6,8,12,14,18, 20 heptamethyl-9-oxodocosa-10,16-dienoate
    • 10,16-Docosadienoic acid, 11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2'R,5S,5'S)-octahydro-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyl[2,2'-bifuran]-5-yl]-9-oxo-, (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-
    • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-trihydroxy-22-((2S,5S)-5-((2R,5S)-5-((1R)-1-hydroxyethyl)-5-methyloxolan-2-yl)-5-methyloxolan-2-yl)-4,6,8,12,14,18,20-heptamethyl-9-oxodocosa-10,16-dienoic acid
    • MDL: MFCD06798385
    • Inchi: 1S/C41H72O9/c1-25(21-29(5)34(43)24-35(44)30(6)22-27(3)20-26(2)14-15-38(46)47)12-11-13-28(4)39(48)31(7)36(45)23-33-16-18-41(10,49-33)37-17-19-40(9,50-37)32(8)42/h11,13,24-33,36-37,39,42-43,45,48H,12,14-23H2,1-10H3,(H,46,47)/b13-11+,34-24-/t25-,26-,27+,28-,29-,30+,31+,32-,33+,36+,37-,39-,40+,41+/m1/s1
    • InChI Key: PGHMRUGBZOYCAA-ADZNBVRBSA-N
    • SMILES: O1[C@](C)([C@@H](C)O)CC[C@@H]1[C@]1(C)CC[C@@H](C[C@@H]([C@H](C)[C@@H]([C@@H](/C=C/C[C@@H](C)C[C@@H](C)/C(=C/C([C@@H](C)C[C@@H](C)C[C@H](C)CCC(=O)O)=O)/O)C)O)O)O1

Computed Properties

  • Exact Mass: 708.51800
  • Monoisotopic Mass: 708.518
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 50
  • Rotatable Bond Count: 22
  • Complexity: 1120
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 14
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 8
  • XLogP3: 7.5
  • Topological Polar Surface Area: 154

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.072±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 204°C-206°C
  • Boiling Point: No data available
  • Flash Point: No data available
  • Refractive Index: 1.512
  • Solubility: Insuluble (4.2E-4 g/L) (25 oC),
  • PSA: 153.75000
  • LogP: 7.79960
  • Sensitiveness: Sensitive to light
  • Solubility: Not determined
  • Vapor Pressure: No data available

Ionomycin Security Information

Ionomycin Customs Data

  • HS CODE:2941500000
  • Customs Data:

    China Customs Code:

    2941500000

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