Cas no 153440-04-1 (a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI))

a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI) structure
153440-04-1 structure
Product Name:a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI)
CAS No:153440-04-1
MF:C108H112O20
MW:1730.03291320801
CID:145244
PubChem ID:16131353
Update Time:2025-04-19

a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI) Chemical and Physical Properties

Names and Identifiers

    • Benzylated cycloisomaltotetraose
    • a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1&reg
    • 6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI)
    • 6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl
    • 6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1&reg
    • 153440-04-1
    • (1S,4R,5R,6S,7R,8S,11R,12R,13S,14R,15S,18R,19R,20S,21R,22S,25R,26R,27S,28R)-5,6,7,12,13,14,19,20,21,26,27,28-dodecakis(phenylmethoxy)-2,9,16,23,29,30,31,32-octaoxapentacyclo[23.3.1.14,8.111,15.118,22]dotriacontane
    • a-D-Glucopyranose,O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-O-2,3,4-tris-O-(phenylmethyl)-a-D-glucopyranosyl-(1®6)-2,3,4-tris-O-(phenylmethyl)-,cyclic anhydride (9CI)
    • Inchi: 1S/C108H112O20/c1-13-37-77(38-14-1)61-109-93-89-73-121-106-102(118-70-86-55-31-10-32-56-86)98(114-66-82-47-23-6-24-48-82)95(111-63-79-41-17-3-18-42-79)91(126-106)75-123-108-104(120-72-88-59-35-12-36-60-88)100(116-68-84-51-27-8-28-52-84)96(112-64-80-43-19-4-20-44-80)92(128-108)76-124-107-103(119-71-87-57-33-11-34-58-87)99(115-67-83-49-25-7-26-50-83)94(110-62-78-39-15-2-16-40-78)90(127-107)74-122-105(125-89)101(117-69-85-53-29-9-30-54-85)97(93)113-65-81-45-21-5-22-46-81/h1-60,89-108H,61-76H2/t89-,90-,91-,92-,93-,94-,95-,96-,97+,98+,99+,100+,101-,102-,103-,104-,105+,106+,107+,108+/m1/s1
    • InChI Key: VNWXTHBSGJGSKF-QRXURSOLSA-N
    • SMILES: O1[C@H]2[C@@H]([C@H]([C@@H]([C@H]1CO[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](CO[C@@H]3[C@@H]([C@H]([C@@H]([C@@H](CO[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](CO2)O4)OCC2C=CC=CC=2)OCC2C=CC=CC=2)OCC2C=CC=CC=2)O3)OCC2C=CC=CC=2)OCC2C=CC=CC=2)OCC2C=CC=CC=2)O1)OCC1C=CC=CC=1)OCC1C=CC=CC=1)OCC1C=CC=CC=1)OCC1C=CC=CC=1)OCC1C=CC=CC=1)OCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 1729.77805079g/mol
  • Monoisotopic Mass: 1728.77469596g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 20
  • Heavy Atom Count: 128
  • Rotatable Bond Count: 36
  • Complexity: 2540
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 20
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 15.8
  • Topological Polar Surface Area: 185?2
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