Cas no 20298-95-7 (MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE)

MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE structure
20298-95-7 structure
Product Name:MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE
CAS No:20298-95-7
MF:C6H17O21P5
MW:580.055388212204
CID:825195
PubChem ID:439468
Update Time:2025-04-19

MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE Chemical and Physical Properties

Names and Identifiers

    • MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE
    • (1R,2S,3r,4R,5S,6r)-6-Hydroxy-1,2,3,4,5-cyclohexanepentayl pentak is[dihydrogen (phosphate)]
    • Dilexpal
    • Hexanicotinoyl inositol
    • Hexanicotol
    • hexa-O-nicotinoyl-myo-inositol
    • inositol 1,3,4,5,6-pentakisphosphate
    • inositol niacinate
    • Inositol nicotinate
    • Inositol pentaphosphate
    • inositol-1,3,4,5,6-pentakisphosphate
    • Inositoli nicotinas
    • Mesotal
    • myo-inositol 1,3,4,5,6-pentakis(phosphate)
    • myo-Inositol 1,3,4,5,6-pentakisphosphate
    • myo-Inositol hexan
    • myo-inositol-1,3,4,5,6-pentakisphosphate
    • CHEBI:16322
    • myo-inositol 1,3,4,5,6-pentakisphosphoric acid
    • myo-Inositol 1,2,3,4,6-pentakisphosphate
    • 5MY
    • K7V
    • I5P
    • DTXSID501015358
    • 20298-95-7
    • myo-inositol 1,3,4,5,6-pentakis(dihydrogen phosphate)
    • 20298-97-9
    • Q27108885
    • Ins(1,3,4,5,6)P5
    • (1R,2S,3S,4R,5S,6s)-6-hydroxycyclohexane-1,2,3,4,5-pentayl pentakis(dihydrogen phosphate)
    • myo-Inositol 1,3,4,5,6-pentakisphosphate ammonium salt
    • Inositol 1,2,3,4,6-pentaphosphate
    • [(1R,2S,4R,5S)-3-hydroxy-2,4,5,6-tetraphosphonooxycyclohexyl] dihydrogen phosphate
    • 1L-myo-inositol 1,2,3,4,6-pentakisphosphate
    • PD040874
    • UNII-T9LY5QE9NQ
    • CHEBI:11369
    • Inositol pentaphosphate, 1,3,4,5,6-
    • SCHEMBL406795
    • Inositol 1,3,4,5,6-pentaphosphate
    • (1R,2S,3R,4R,5S,6r)-6-hydroxycyclohexane-1,2,3,4,5-pentayl pentakis(dihydrogen phosphate)
    • rel-(1R,2S,3S,4R,5S,6s)-6-Hydroxycyclohexane-1,2,3,4,5-pentayl pentakis(dihydrogen phosphate)
    • myo-Inositol-1,3,4,5,6-pentaphosphate ammonium salt
    • myo-Inositol pentakisphosphate
    • T9LY5QE9NQ
    • DTXSID90331416
    • 8444PN9XUW
    • 1D-myo-Inositol 1,3,4,5,6-pentakisphosphate
    • Myo-inositol, 1,2,3,4,6-pentakis(dihydrogen phosphate)
    • UNII-8444PN9XUW
    • Q27101851
    • C01284
    • Myo-Inositol 1,3,4,5,6-pentaphosphate
    • 1L-myo-inositol 1,2,3,4,6-pentakis(dihydrogen phosphate)
    • Myo-inositol, 1,3,4,5,6-pentakis(dihydrogen phosphate)
    • myo-Inositol 1,2,3,4,6-pentakis-phosphate, >=85% (HPLC)
    • neo-Inositol pentakisphosphate
    • Ins(1,2,3,4,6)P5
    • (D)-isomer, specified as 1,2,4,5,6 of inositol pentaphosphate
    • (1R,2S,3r,4R,5S,6r)-6-hydroxycyclohexane-1,2,3,4,5-pentayl pentakis[dihydrogen (phosphate)]
    • D-myo-Inositol 1,3,4,5,6-pentakisphosphate
    • Myo-Inositol-(1,3,4,5,6)-Pentakisphosphate
    • Inchi: 1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)
    • InChI Key: CTPQAXVNYGZUAJ-UHFFFAOYSA-N
    • SMILES: OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O

Computed Properties

  • Exact Mass: 579.89504254g/mol
  • Monoisotopic Mass: 579.89504254g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 11
  • Hydrogen Bond Acceptor Count: 21
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 10
  • Complexity: 824
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -9.2
  • Topological Polar Surface Area: 354?2

MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE Security Information

  • WGK Germany:3

MYO-INOSITOL 1,3,4,5,6-PENTAKIS-PHOSPHATE Pricemore >>

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