Compound: SUCROSE OCTAACETATE
SMILES: O=C(O[C@H]1[C@H](O[C@H](COC(=O)C)[C@H]([C@@H]1OC(=O)C)OC(=O)C)O[C@@]2(O[C@H](COC(=O)C)[C@H]([C@@H]2OC(=O)C)OC(=O)C)COC(=O)C)C
InChIKey: ZIJKGAXBCRWEOL-SAXBRCJISA-N
Synonyms: SUCROSE OCTAACETATE, 126-14-7, Octaacetylsucrose, FEMA No. 3038, sucrose octa-acetate, DTXSID3042423, NSC-1695, alpha-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-beta-D-fructofuranosyl, tetraacetate, 07V591057T, DTXCID1022423, [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2S,3S,4R,5R)-3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl acetate, sucrose octa acetate, ((2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-((2S,3S,4R,5R)-3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl)oxyoxan-2-yl)methyl acetate, RefChem:186404, GlyTouCan:G43789DD, G43789DD, 204-772-1, Octaacetyl sucrose, Octa-O-acetyl D-(+)-Sucrose, Octa-O-acetylsucrose, D-(+)-Sucrose octaacetate, MFCD00006623, D-(+)-Saccharose Octaacetate, alpha-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-beta-D-fructofuranosyl, 2,3,4,6-tetraacetate, Sucrose octaacetate [NF], NCGC00160615-01, Sucrose octaacetate (NF), (2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(((2S,3S,4R,5R)-3,4-diacetoxy-2,5-bis(acetoxymethyl)tetrahydrofuran-2-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate, a-D-Glucopyranoside,1,3,4,6-tetra-O-acetyl-b-D-fructofuranosyl, 2,3,4,6-tetraacetate, CAS-126-14-7, NSC 1695, EINECS 204-772-1, BRN 0079290, AI3-00071, sucrose-octaacetate, UNII-07V591057T, 2,3,4,6,1',3',4',6'-Octa-O-acetylsucrose, D-Saccharose octaacetate, 1,3,4,6-Tetra-O-acetyl-beta-D-fructofuranosyl-alpha-D-glucopyranoside tetraacetate, SCHEMBL48906, 5-17-08-00410 (Beilstein Handbook Reference), Sucrose octaacetate (Standard), orb1307719, CHEMBL2105790, SUCROSE OCTAACETATE [MI], CHEBI:180783, Octa-O-acetyl D-(+)-Saccharose, SUCROSE OCTAACETATE [FHFI], Sucrose octaacetate, >=97%, FG, D-(+)-Sucrose octaacetate, 98%, Tox21_111938, Tox21_300386, SUCROSE OCTAACETATE [USP-RS], SUCROSE OCTA-ACETATE [MART.], AKOS015895274, SUCROSE OCTA-ACETATE [WHO-DD], Tox21_111938_1, HY-119309R, OS03658, 1,3,4,6-Tetra-O-acetyl-beta-D-fructofuranosyl-alpha-D-glucopyrano- side tetraacetate, alpha-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-beta-D-fructofuranosyl, tetracetate, NCGC00160615-02, NCGC00160615-03, NCGC00254310-01, [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(2S,3S,4R,5R)-3,4-diacetoxy-2,5-bis(acetoxymethyl)tetrahydrofuran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate, BS-15102, SY059951, HY-119309, CS-0066987, NS00014139, S0052, D-(+)-Sucrose octaacetate, analytical standard, D05935, F20296, SBI-0654056.0001, F817908, Q410482, SR-01000883711, SR-01000883711-1, BRD-K01294196-001-01-5, Sucrose octaacetate, United States Pharmacopeia (USP) Reference Standard, |A-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-|A-D-fructofuranosyl, 2,3,4,6-tetraacetate, 1,3,4,6-Tetra-O-acetyl-beta-D-fructofuranosyl 2,3,4,6-tetra-O-acetyl-alpha-D-glucopyranoside
Theoretical properties:
molecular_formula: C28H38O19
molecular_weight: 678.6 g/mol
exact_mass: 678.20072898 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 19
rotatable_bond_count: 21
heavy_atom_count: 47
topological_polar_surface_area: 238 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Sucrose octaacetate is a glycoside.
chembl: SUCROSE OCTAACETATE is a small molecule listed in the ChEMBL database and has reached clinical trial phase -1.0.
wikipedia: Sucrose octaacetate is a chemical compound with formula C28H38O19or (C2H3O2)8(C12H14O3), an eight-fold ester of sucrose and acetic acid. Its molecule can be described as that of  sucrose C12H22O11 with its eight hydroxyl groups HO– replaced by acetate groups H3C–CO2–.  It is a crystalline solid, colorless  and odorless but intensely bitter.
Sucrose octaacetate is used as an inert ingredient in pesticides and herbicides, as a bitter additive.