3-(Hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl O-α-D-galactopyranosyl-(1→4)-O-β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside

CAS Registry Number®

127542-54-5

CAS Name

3-(Hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl O-α-D-galactopyranosyl-(1→4)-O-β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside

Molecular Formula

C54H104O20S2

Molecular Mass

1137.52

Cite this Page

3-(Hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl O-α-D-galactopyranosyl-(1→4)-O-β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=127542-54-5 (retrieved 2024-11-24) (CAS RN: 127542-54-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C54H104O20S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-75(65,66)37-39(38-76(67,68)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)36-69-52-48(63)45(60)50(41(34-56)71-52)74-54-49(64)46(61)51(42(35-57)72-54)73-53-47(62)44(59)43(58)40(33-55)70-53/h39-64H,3-38H2,1-2H3/t40-,41-,42-,43+,44+,45-,46-,47-,48-,49-,50-,51+,52-,53-,54+/m1/s1

InChIKey

InChIKey=VRODFFFMOXQLQM-BFLIEDCBSA-N

SMILES

O([C@H]1[C@@H](CO)O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](OCC(CS(CCCCCCCCCCCCCCCC)(=O)=O)CS(CCCCCCCCCCCCCCCC)(=O)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O

Canonical SMILES

O=S(=O)(CCCCCCCCCCCCCCCC)CC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)CS(=O)(=O)CCCCCCCCCCCCCCCC

Other Names for this Substance

  • β-D-Glucopyranoside, 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl O-α-D-galactopyranosyl-(1→4)-O-β-D-galactopyranosyl-(1→4)-
  • 3-(Hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl O-α-D-galactopyranosyl-(1→4)-O-β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside

CAS INSIGHTSTM
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