CAS 126054-77-1|Atractyloside A

Introduction:Basic information about CAS 126054-77-1|Atractyloside A, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameAtractyloside A
CAS Number126054-77-1Molecular Weight448.504
Density1.4±0.1 g/cm3Boiling Point684.8±55.0 °C at 760 mmHg
Molecular FormulaC21H36O10Melting Point/
MSDS/Flash Point234.1±25.0 °C

Names

Name2-[(3S,3aR,5R,8R,8aS)-3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2- oxodecahydro-5-azulenyl]-2-propanyl β-D-glucopyranoside
SynonymMore Synonyms

Atractyloside A BiologicalActivity

DescriptionAtractyloside A(126054-77-1) is a natural TCM reference compound.
Related CatalogSignaling Pathways >>Others >>OthersNatural Products >>Terpenoids and GlycosidesResearch Areas >>Others

Chemical & Physical Properties

Density1.4±0.1 g/cm3
Boiling Point684.8±55.0 °C at 760 mmHg
Molecular FormulaC21H36O10
Molecular Weight448.504
Flash Point234.1±25.0 °C
Exact Mass448.230835
PSA177.14000
LogP-3.63
Vapour Pressure0.0±4.8 mmHg at 25°C
Index of Refraction1.600
InChIKeyQNBLVYVBWDIWDM-BSLJOXIBSA-N
SMILESCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC(O)(CO)C2CC(=O)C(C)(O)C2C1
Storage condition-20°C

Synonyms

(+)-(1S,4S,4aR,8aS)-4-((3S)-3-hydroxy-3-methyl-4-pentenyl)-4a,8,8-trimethyl-3-methylenedecahydro-1-naphthalenol
atractyloside A
LARIXOL ACETATE
2-[(3S,3aR,5R,8R,8aS)-3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2-oxodecahydro-5-azulenyl]-2-propanyl β-D-glucopyranoside
2-[(3S,3aR,5R,8R,8aS)-3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2-oxodecahydroazulen-5-yl]propan-2-yl β-D-glucopyranoside
2(1H)-Azulenone, 7-[1-(β-D-glucopyranosyloxy)-1-methylethyl]octahydro-1,4-dihydroxy-4-(hydroxymethyl)-1-methyl-, (1S,3aS,4R,7R,8aR)-
[(1S,4R,4aR,8aS)-4-[(3S)-3-acetyloxy-3-methylpent-4-enyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate
(1S,4S,4aR,8aS)-4-[(3S)-3-Hydroxy-3-methylpent-4-enyl]-4a,8,8-trimethyl-3-methylenedecahydronaphthalen-1-ol
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