ChemicalBook--->CAS DataBase List--->26544-34-3

26544-34-3

26544-34-3 Structure

26544-34-3 Structure
IdentificationBack Directory
[Name]

APIIN
[CAS]

26544-34-3
[Synonyms]

APIIN
APIOSIDE
APIIN(P)
Apiin ,98%
26544-34-3
APIIN USP/EP/BP
APIGENIN-7-APIOGLUCOSIDE
APIGENIN-7-APIOSYLGLUCOSIDE
7-(2-APIOSYLGLUCOSYL)APIGENIN
APIGENIN-7-(2-O-APIOSYLGLUCOSIDE)
4H-1-Benzopyran-4-one,7-[(2-O-D-apio-β-D
-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-
7-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
4H-1-Benzopyran-4-one,7-[(2-O-D-apio-b-D-furanosyl-b-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-
4H-1-Benzopyran-4-one, 7-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-
4H-1-Benzopyran-4-one, 7-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-
7-[(2-O-D-apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
APIIN:4H-1-BENZOPYRAN-4-ONE,7-[(2-O-D-APIO--D-FURANOSYL--D-GLUCOPYRANOSYL)OXY]-5-HYDROXY-2-(4-HYDROXYPHENYL)-,
4H-1-BENZOPYRAN-4-ONE,7-[(2-O-D-APIO-BETA-D-FURANOSYL-BETA-D-GLUCOPYRANOSYL)OXY]-5-HYDROXY-2-(4-HYDROXYPHENYL)-
7-(((2S,3R,4S,5S,6R)-3-(((2S,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
[EINECS(EC#)]

247-780-0
[Molecular Formula]

C26H28O14
[MDL Number]

MFCD00016941
[MOL File]

26544-34-3.mol
[Molecular Weight]

564.49
Chemical PropertiesBack Directory
[Melting point ]

230°C (dec.)
[Boiling point ]

942.2±65.0 °C(Predicted)
[density ]

1.74±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly, Sonicated)
[form ]

Solid
[pka]

6.11±0.40(Predicted)
[color ]

Pale Yellow
[Stability:]

Hygroscopic
[Major Application]

food and beverages
[InChIKey]

NTDLXWMIWOECHG-MFMSCHSJSA-N
[SMILES]

OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C=C(Oc3c2)c4ccc(O)cc4)[C@H](O[C@@H]5OC[C@](O)(CO)[C@@H]5O)[C@@H](O)[C@@H]1O
[LogP]

0.720 (est)
Safety DataBack Directory
[WGK Germany ]

1
[F ]

3-10
[HS Code ]

29389090
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

Yellow crystals, soluble in methanol, ethanol, DMSO and other organic solvents, derived from celery seeds, Anthemis nobilis, Apium graveolens, Matricaria chamomilla [Syn. Matricaria recuJita], Ircia hirsuta, and curly parsley.
[Uses]

Apiin is an extract flavonoid compound from parsley which shows inhibition towards viral neuramindase. It also shows antiproliferative and apoptotic effects towards human cancer cells.
[Definition]

ChEBI: A beta-D-glucoside having a beta-D-apiosyl residue at the 2-position and a 5,4'-dihydroxyflavon-7-yl moiety at the anomeric position.
[Biological Activity]

Apiina major flavonoid component of celeryshows antiinflammatory activity mediated through inhibition of nitric oxide synthesis and inhibition of iNOS expression.
Spectrum DetailBack Directory
[Spectrum Detail]

APIIN(26544-34-3)1HNMR
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