D(+)-Raffinose Pentahydrate

• CAS: 17629-30-0
• Catalog Number: ACM17629300
• Category: Other Products
• Molecular Weight: 594.51
• Molecular Formula: C18H42O21
• Description: Raffinose is a trisaccharide composed of galactose, glucose, and fructose. It can be found in beans, cabbage, brussels sprouts, broccoli, asparagus, other vegetables, and whole grains. Raffinose can be hydrolyzed to D-galactose and sucrose by the enzyme α-galactosidase (α-GAL), an enzyme not found in the human digestive tract. α-GAL also hydrolyzes other α-galactosides such as stachyose, verbascose, and galactinol, if present. The enzyme does not cleave β-linked galactose, as in lactose.The raffinose family of oligosaccharides (RFOs) are alpha-galactosyl derivatives of sucrose, and the most common are the trisaccharide raffinose, the tetrasaccharide stachyose, and the pentasaccharide verbascose. RFOs are almost ubiquitous in the plant kingdom, being found in a large variety of seeds from many different families, and they rank second only to sucrose in abundance as soluble carbohydrates.Humans and other monogastric animals (pigs and poultry) do not possess the α-GAL enzyme to break down RFOs and these oligosaccharides pass undigested through the stomach and upper intestine. In the lower intestine, they are fermented by gas-producing bacteria that do possess the α-GAL enzyme and make carbon dioxide, methane or hydrogen—leading to the flatulence commonly associated with eating beans and other vegetables. α-GAL is present in digestive aids such as the product Beano.Procedures concerning cryopreservation have used raffinose to provide hypertonicity for cell desiccation prior to freezing. Either raffinose or sucrose is used as a base substance for sucralose.
• Synonyms: Raffinose, 5-hydrate
• IUPAC Name: (3R,4S,5R,6R)-2-[[(2R,3S,4S,5R)-6-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol;pentahydrate
• Canonical SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)O)CO)O)O)O)O)O)O)O.O.O.O.O.O
• InChI: InChI=1S/C18H32O16.5H₂O/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18;;;;;/h5-17,19-29H,1-4H2;5*1H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16?,17?,18+;;;;;/m1...../s1
• InChI Key: BITMAWRCWSHCRW-XRZHKTLCSA-N
• Boiling Point: 78-82 °C
• Melting Point: 78-80 °C
• Density: 1.465 g/cm³
• Appearance: White powder
• Storage: Inert atmosphere, room temperature
• Complexity: 655
• EC Number: 208-146-9
• Exact Mass: 594.22185834
• Hazard Codes: Xi
• Hazard Statements: Xi
• HS Code: 2932999099
• Isomeric SMILES: C([C@@H]1[C@@H]([C@@H]([C@H](C(O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O)O)O)O.O.O.O.O.O
• LogP: -7.89290
• MDL Number: MFCD00071590
• Monoisotopic Mass: 594.22185834
• Odor: Odorless
• Physical State: Powder
• PSA: 314.83
• Safety Description: 24/25-37/39-26
• Solubility In Water: 143 g/L
• Storage Conditions: Inert atmosphere,Room Temperature
• Topological Polar Surface Area: 274 Ų
• WGK Germany: 3

Custom Q&A

What is the molecular formula of D(+)-Raffinose pentahydrate?

The molecular formula of D(+)-Raffinose pentahydrate is C18H42O21.

What is the molecular weight of D(+)-Raffinose pentahydrate?

The molecular weight of D(+)-Raffinose pentahydrate is 594.5 g/mol.

What is the IUPAC name of D(+)-Raffinose pentahydrate?

The IUPAC name of D(+)-Raffinose pentahydrate is (3R,4S,5R,6R)-2-[[(2R,3S,4S,5R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol;pentahydrate.

What is the InChI of D(+)-Raffinose pentahydrate?

The InChI of D(+)-Raffinose pentahydrate is InChI=1S/C18H32O16.5H2O/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18;;;;;/h5-17,19-29H,1-4H2;5*1H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16?,17?,18+;;;;;/m1...../s1.

What is the InChIKey of D(+)-Raffinose pentahydrate?

The InChIKey of D(+)-Raffinose pentahydrate is BITMAWRCWSHCRW-XRZHKTLCSA-N.

What is the canonical SMILES of D(+)-Raffinose pentahydrate?

The canonical SMILES of D(+)-Raffinose pentahydrate is C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)O)CO)O)O)O)O)O)O)O.O.O.O.O.O.

What is the CAS number of D(+)-Raffinose pentahydrate?

The CAS number of D(+)-Raffinose pentahydrate is 17629-30-0.

What is the European Community (EC) number of D(+)-Raffinose pentahydrate?

The European Community (EC) number of D(+)-Raffinose pentahydrate is 605-771-2.

What is the hydrogen bond donor count of D(+)-Raffinose pentahydrate?

The hydrogen bond donor count of D(+)-Raffinose pentahydrate is 16.

What is the hydrogen bond acceptor count of D(+)-Raffinose pentahydrate?

The hydrogen bond acceptor count of D(+)-Raffinose pentahydrate is 21.