Cas no 93836-11-4 (a-D-Glucopyranoside, methyl4-O-[4-(a-D-glucopyranosyloxy)-4-methoxybutyl]-,(R)- (9CI))

a-D-Glucopyranoside, methyl4-O-[4-(a-D-glucopyranosyloxy)-4-methoxybutyl]-,(R)- (9CI) structure
93836-11-4 structure
Product Name:a-D-Glucopyranoside, methyl4-O-[4-(a-D-glucopyranosyloxy)-4-methoxybutyl]-,(R)- (9CI)
CAS No:93836-11-4
MF:C18H34O13
MW:458.45476770401
CID:807490
PubChem ID:125090
Update Time:2025-04-19

a-D-Glucopyranoside, methyl4-O-[4-(a-D-glucopyranosyloxy)-4-methoxybutyl]-,(R)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • a-D-Glucopyranoside, methyl4-O-[4-(a-D-glucopyranosyloxy)-4-methoxybutyl]-,(R)- (9CI)
    • 2-[4-[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-1-methoxybutoxy]-6-methoxyoxane-3,4,5-triol
    • methyl 4-O-(4 alpha-glucopyranosyloxy-4-methoxybutyl)-alpha-glucopyranoside
    • 93836-11-4
    • alpha-D-Glucopyranoside, methyl 4-O-(4-(alpha-D-glucopyranosyloxy)-4-methoxybutyl)-, (R)-
    • Methyl 4-O-(4alpha-glucopyranosyloxy-4-methoxybutyl)-alpha-glucopyranoside
    • Mgombg
    • Inchi: 1S/C18H34O13/c1-25-9(30-18-13(23)10(20)12(22)17(27-3)31-18)5-4-6-28-15-8(7-19)29-16(26-2)14(24)11(15)21/h8-24H,4-7H2,1-3H3
    • InChI Key: FMYOXSHBEZIKNA-UHFFFAOYSA-N
    • SMILES: O1C(C(C(C(C1CO)OCCCC(OC)OC1C(C(C(C(OC)O1)O)O)O)O)O)OC

Computed Properties

  • Exact Mass: 458.19994113g/mol
  • Monoisotopic Mass: 458.19994113g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 11
  • Complexity: 511
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 11
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.5
  • Topological Polar Surface Area: 186?2
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