ChemicalBook--->CAS DataBase List--->38412-46-3

38412-46-3

38412-46-3 Structure

38412-46-3 Structure
IdentificationBack Directory
[Name]

ALOENIN A
[CAS]

38412-46-3
[Synonyms]

ALOENIN A
ALOENIN A(SH)
Aloenin A, 98%, from Aloe L.
Aloenin A from Aloe arborescens
6-[2-(β-D-Glucopyranosyloxy)-4-hydroxy-6-methylphenyl]-4-methoxy-2H-pyran-2-one
2H-Pyran-2-one, 6-[2-(b-D-glucopyranosyloxy)-4-hydroxy-6-methylphenyl]-4-methoxy-
2H-Pyran-2-one, 6-[2-(β-D-glucopyranosyloxy)-4-hydroxy-6-methylphenyl]-4-methoxy-
6-[2-(beta-D-Glucopyranosyloxy)-4-hydroxy-6-methylphenyl]-4-methoxy-2H-pyran-2-one
6-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-m
6-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-methoxypyran-2-one
[Molecular Formula]

C19H22O10
[MDL Number]

MFCD08275450
[MOL File]

38412-46-3.mol
[Molecular Weight]

410.37
Chemical PropertiesBack Directory
[Melting point ]

145℃
[Boiling point ]

787.8±60.0 °C(Predicted)
[density ]

1.56
[storage temp. ]

-20°C
[solubility ]

Acetone: Soluble
Chloroform: Soluble
Dichloromethane: Soluble
DMSO: SolubleEthyl Acetate: Soluble
[form ]

neat
[pka]

9.68±0.40(Predicted)
[color ]

Off-white to light yellow
[InChI]

1S/C19H22O10/c1-8-3-9(21)4-11(15(8)12-5-10(26-2)6-14(22)27-12)28-19-18(25)17(24)16(23)13(7-20)29-19/h3-6,13,16-21,23-25H,7H2,1-2H3/t13-,16-,17+,18-,19-/m1/s1
[InChIKey]

KFJNVVJUICKJEQ-LQDZTQBFSA-N
[SMILES]

COC1=CC(=O)OC(=C1)c2c(C)cc(O)cc2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

Green powder, soluble in organic solvents such as methanol, ethanol, and DMSO, derived from the leaves of Aloe vera L. var. chinensis (Haw.) Berger, a plant of the Liliaceae family.
[Uses]

Aloenin A is a compound obtained from Genus Aloe, Xanthorrhoeaceae and is used in diabetic wound healing as well as other cardiovascular diseases in traditional medicine.
[Definition]

ChEBI: Aloenin is a glycoside.
[storage]

4°C, protect from light
[References]

[1] YUUSUKE MIZUUCHI. Novel type III polyketide synthases from Aloe arborescens[J]. The FEBS journal, 2009, 276 8: 2391-2401. DOI: 10.1111/j.1742-4658.2009.06971.x
[2] De Souza, F.I., Zumiotti, A.V., and Da Silva, C.F. Neuregulins 1-α and 1-β on the regeneration the peripheral nerves[J]. Acta Ortop Bras.
[3] NEHA DEORA  Krishnan V. Lipase activity inhibited by aloenin A: Glycoside from Aloe vera (L.) Burm. f.—In vitro and molecular docking studies[J]. Journal of Molecular Recognition, 2022, 36 2. DOI: 10.1002/jmr.3002
[4] BO GAO. [Active constituents from Aloe arborescens as BACE inhibitors].[J]. Yaoxue Xuebao, 2006, 41 10: 1000-1003.
[5] De Souza, F.I., Zumiotti, A.V., and Da Silva, C.F. Neuregulins 1-α and 1-β on the regeneration the peripheral nerves[J]. Acta Ortop Bras.
[6] T. HIRATA T S. Structure of Aloenin, a New Biologically-active Bitter Glucoside from Aloe arborescens var. natalensis[J]. Bulletin of the Chemical Society of Japan, 1978, 56 1: 842-849. DOI: 10.1246/bcsj.51.842
Spectrum DetailBack Directory
[Spectrum Detail]

ALOENIN A(38412-46-3)1HNMR
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