2,2-Dioctyl-1,3-propanediyl bis[4-O-α-D-glucopyranosyl-β-D-glucopyranoside

CAS Registry Number®

1257852-99-5

CAS Name

2,2-Dioctyl-1,3-propanediyl bis[4-O-α-D-glucopyranosyl-β-D-glucopyranoside

Molecular Formula

C43H80O22

Molecular Mass

949.08

Cite this Page

2,2-Dioctyl-1,3-propanediyl bis[4-O-α-D-glucopyranosyl-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1257852-99-5 (retrieved 2024-12-24) (CAS RN: 1257852-99-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C43H80O22/c1-3-5-7-9-11-13-15-43(16-14-12-10-8-6-4-2,21-58-39-35(56)31(52)37(25(19-46)62-39)64-41-33(54)29(50)27(48)23(17-44)60-41)22-59-40-36(57)32(53)38(26(20-47)63-40)65-42-34(55)30(51)28(49)24(18-45)61-42/h23-42,44-57H,3-22H2,1-2H3/t23-,24-,25-,26-,27-,28-,29+,30+,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-/m1/s1

InChIKey

InChIKey=GDAZOFIUKHGYGD-VLJUBQHSSA-N

SMILES

C(CO[C@@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)(CO[C@@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)(CCCCCCCC)CCCCCCCC

Canonical SMILES

OCC1OC(OC2C(O)C(O)C(OCC(COC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)(CCCCCCCC)CCCCCCCC)OC2CO)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, 2,2-dioctyl-1,3-propanediyl bis[4-O-α-D-glucopyranosyl-
  • 2,2-Dioctyl-1,3-propanediyl bis[4-O-α-D-glucopyranosyl-β-D-glucopyranoside

CAS INSIGHTSTM
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