ChemicalBook--->CAS DataBase List--->174972-79-3

174972-79-3

174972-79-3 Structure

174972-79-3 Structure
IdentificationBack Directory
[Name]

[2-(Carboxymethyl)-2-hydroxy-1,4-dioxo-1,4-butanediyl]bis(oxymethylene-4,1-phenylene) bis-beta-D-glucopyranoside
[CAS]

174972-79-3
[Synonyms]

Parishin B
β-D-Glucopyranoside, [2-(carboxymethyl)-2-hydroxy-1,4-dioxo-1,4-butanediyl]bis(oxymethylene-4,1-phenylene) bis-
[2-(Carboxymethyl)-2-hydroxy-1,4-dioxo-1,4-butanediyl]bis(oxymethylene-4,1-phenylene) bis-beta-D-glucopyranoside
[2-(Carboxymethyl)-2-hydroxy-1,4-dioxo-1,4-butanediyl]bis(oxymethylene-4,1-phenylene) bis-beta-D-glucopyranoside USP/EP/BP
[Molecular Formula]

C32H40O19
[MDL Number]

MFCD29048568
[MOL File]

174972-79-3.mol
[Molecular Weight]

728.65
Chemical PropertiesBack Directory
[Boiling point ]

1048.2±65.0 °C(Predicted)
[density ]

1.600
[storage temp. ]

2-8°C
[solubility ]

DMF: 5 mg/ml; DMSO: 5 mg/ml; PBS (pH 7.2): 2 mg/ml
[form ]

A solid
[pka]

3.77±0.21(Predicted)
[color ]

White to off-white
[InChIKey]

UNLDMOJTKKEMOG-IWOWLDPGSA-N
[SMILES]

O[C@H]1[C@H](OC2=CC=C(COC(CC(CC(O)=O)(O)C(OCC3=CC=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)C=C3)=O)=O)C=C2)O[C@H](CO)[C@@H](O)[C@@H]1O
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P264-P270-P301+P312-P330-P501
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

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

White crystalline powder, soluble in methanol, ethanol, DMSO and other organic solvents.
[Uses]

Parishin B is a component of Gastrodia elata which is used in traditional Chinese medicine in the treatment of diabetes.
[Definition]

ChEBI: Parishin B is a glycoside.
Spectrum DetailBack Directory
[Spectrum Detail]

Parishin B(174972-79-3)1HNMR
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