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stachyose

Molecular FormulaC₂₄H₄₂O₂₁
Average mass666.578 Da
Monoisotopic mass666.221863 Da
ChemSpider ID388624

- 19 of 19 defined stereocentres

More details:

Names and Synonyms
Database ID(s)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

54261-98-2 [RN]

D-Stachyose

stachyose [Wiki]

Stachyose -

α-D-Galactopyranosyl-(1->6)-α-D-galactopyranosyl-(1->6)-α-D-glucopyranoside de β-D-fructofuranosyle [French] [ACD/IUPAC Name]

α-D-Glucopyranoside, β-D-fructofuranosyl O-α-D-galactopyranosyl-(1->6)-O-α-D-galactopyranosyl-(1->6)- [ACD/Index Name]

β-D-Fructofuranosyl α-D-galactopyranosyl-(1->6)-α-D-galactopyranosyl-(1->6)-α-D-glucopyranoside [ACD/IUPAC Name]

β-D-Fructofuranosyl-α-D-galactopyranosyl-(1->6)-α-D-galactopyranosyl-(1->6)-α-D-glucopyranosid [German] [ACD/IUPAC Name]

β-D-Fructofuranosyl-α-D-galactopyranosyl-(1->6)-α-D-galactopyranosyl-(1->6)-α-D-glucopyranoside

&α;-D-Galp-(1->6)-&α;-D-Galp-(1->6)-&α;-D-Glcp-(1->2)-&β;-D-Fruf

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&α;-D-Galp-(1->6)-&α;-D-Galp-(1->6)-&α;-D-Glcp-(1->2)-&β;-D-Fruf|(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-<i>bis</i>(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2R,3R,4S,5S,6R)-2-(((2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-6-((((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-((((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triol

(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2S,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6S)-6-[[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2S,3R,4S,5R,6R)-2-{[(2R,3R,4S,5R,6S)-6-{[(2R,3S,4S,5R,6R)-6-{[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-

?-D-Galp-(1->6)-?-D-Galp-(1->6)-?-D-Glcp-(1<->2)-?-D-Fruf

10094-58-3 [RN]

207-427-3 [EINECS]

90%

Lupeose

MFCD00006631 [MDL number]

MFCD00149457 [MDL number]

O-α-D-galactopyranosyl-(1->6)o-α-D-galactopyranosyl-(1->6)O-α-D-galactopyranosyl-β-D-fructofuranoside

α-D-Galactosyl-α-D-galactosyl-α-D-glucosyl-β-D-fructose

α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1<->;2)-β-D-Fruf

β-D-fructofuranosyl O-α-D-galactopyranosyl-(1->6)-O-α-D-galactopyranosyl-(1->6)-α-D-Glucopyranoside

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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

10094-58-3; 470-55-3 [DBID]

10094-58-3470-55-3 [DBID]

bmse000240 [DBID]

C01613 [DBID]

CHEBI:17164 [DBID]

Experimental data
Predicted - ACD/Labs
Predicted - ChemAxon

Miscellaneous

Target Organs:

Others TargetMol T2713

Chemical Class:

Bio Activity:

Others TargetMol T2713

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:	1.8±0.1 g/cm³
Boiling Point:	1044.2±65.0 °C at 760 mmHg
Vapour Pressure:	0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization:	172.9±6.0 kJ/mol
Flash Point:	585.3±34.3 °C
Index of Refraction:	1.690
Molar Refractivity:	138.3±0.4 cm³
#H bond acceptors:	21
#H bond donors:	14
#Freely Rotating Bonds:	11
#Rule of 5 Violations:	3

ACD/LogP:	-2.88
ACD/LogD (pH 5.5):	-3.85
ACD/BCF (pH 5.5):	1.00
ACD/KOC (pH 5.5):	1.00
ACD/LogD (pH 7.4):	-3.85
ACD/BCF (pH 7.4):	1.00
ACD/KOC (pH 7.4):	1.00
Polar Surface Area:	348 Å²
Polarizability:	54.8±0.5 10^-24cm³
Surface Tension:	126.4±5.0 dyne/cm
Molar Volume:	362.0±5.0 cm³

Click to predict properties on the Chemicalize site

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stachyose

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