Cas no 512-65-2 (α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)-)

α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)- structure
512-65-2 structure
Product Name:α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)-
CAS No:512-65-2
MF:C24H42O21
MW:666.577690601349
CID:1574483
PubChem ID:25079986
Update Time:2024-03-01

α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)- Chemical and Physical Properties

Names and Identifiers

    • (2S,3R,4S,5R,6S)-6-{[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}methyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydrofuran-2-yl]methoxy}
    • (2S,3R,4S,5R,6S)-6-{[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}methyl)tet
    • α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)-
    • Q27103221
    • Hexopyranosyl-(1->1)hex-2-ulofuranosyl hexopyranosyl-(1->6)hexopyranoside
    • 1(F)-alpha-D-galactosylraffinose
    • 512-65-2
    • CHEBI:27603
    • alpha-D-Gal-(1->6)-alpha-D-Glc-(1->2)-beta-D-Fru-(1?1)-alpha-D-Gal
    • 1F-alpha-D-Galactosylraffinose
    • C08242
    • DTXSID40965467
    • Lychnose
    • (2S,3R,4S,5R,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • alpha-D-galactopyranosyl-(1->1)-beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside
    • Inchi: 1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-4-9-12(30)16(34)19(37)23(43-9)45-24(20(38)13(31)8(3-27)44-24)5-40-22-18(36)15(33)11(29)7(2-26)42-22/h6-23,25-38H,1-5H2
    • InChI Key: BNOGJEJAYILSFT-UHFFFAOYSA-N
    • SMILES: C(O)C1OC(OCC2OC(OC3(OC(CO)C(O)C3O)COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O

Computed Properties

  • Exact Mass: 666.22185834g/mol
  • Monoisotopic Mass: 666.22185834g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 14
  • Hydrogen Bond Acceptor Count: 21
  • Heavy Atom Count: 45
  • Rotatable Bond Count: 11
  • Complexity: 933
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 19
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -8
  • Topological Polar Surface Area: 348?2

α-D-Glucopyranoside, O-α-D-galactopyranosyl-(1→1)-O-β-D-fructofuranosyl O-α-D-galactopyranosyl-(1→6)- Related Literature

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