ChemicalBook--->CAS DataBase List--->27741-01-1

27741-01-1

27741-01-1 Structure

27741-01-1 Structure
IdentificationBack Directory
[Name]

Geniposidic acid
[CAS]

27741-01-1
[Synonyms]

Osidic acid
PreMnosidic acid
GENIPOSIDIC ACID
GENIPOSIDIC ACID(SH)
Geniposidic acid std.
Geniposidic Acid Standard
Geniposidic acid USP/EP/BP
Geniposidic acid, 98%, from Gardenia jasminoides Ellis
1α-(β-D-Glucopyranosyloxy)-1,4aα,5,7aα-tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid
(1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,7aα-tetrahydro-7-hydroxymethylcyclopenta[c]pyran-4-carboxylic acid
(1S,4aS,7aS)-7-(Hydroxymethyl)-1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S,4aS,7aS)-
(1R,2S,6S)-9-(Hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]nona-4,8-diene-5-carboxylic acid
(1S,4aS,7aS)-7-(hydroxymethyl)-1-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
[Molecular Formula]

C16H22O10
[MDL Number]

MFCD00210294
[MOL File]

27741-01-1.mol
[Molecular Weight]

374.34
Chemical PropertiesBack Directory
[Melting point ]

138-140 °C(Solv: methanol (67-56-1))
[Boiling point ]

684.1±55.0 °C(Predicted)
[density ]

1?+-.0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

DMF:30.0(Max Conc. mg/mL);80.14(Max Conc. mM)
DMSO:48.67(Max Conc. mg/mL);130.01(Max Conc. mM)
[form ]

powder
[pka]

4.49±0.60(Predicted)
[color ]

White
[InChIKey]

ZJDOESGVOWAULF-OVSXCSOGNA-N
[SMILES]

[C@@]12([H])C(CO)=CC[C@]1([H])C(C(=O)O)=CO[C@H]2O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O |&1:0,7,15,17,18,20,21,23,r|
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

29389090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

White crystalline powder, easily soluble in water, ethanol, and methanol, poorly soluble in n-butanol and ethyl acetate, insoluble in chloroform, benzene, and petroleum ether, derived from Gardenia jasminoides, Ixora chinensis, Eucommia ulmoides, and Herba Lycopodii.
[Uses]

Geniposidic acid is an effective anticancer and radioprotection agent. Geniposidic acid might be a more potent tumor growth inhibitor than geniposide (GP) when combined with the X-irradiation, though there was no significant synergetic effect on their com
[Definition]

ChEBI: Geniposidic acid is a terpene glycoside.
[target]

HO-1 | IL Receptor | Caspase | FXR | MRP2 | BSEP
[IC 50]

Human Endogenous Metabolite
Spectrum DetailBack Directory
[Spectrum Detail]

Geniposidic acid(27741-01-1)MS
Geniposidic acid(27741-01-1)1HNMR
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