Geniposidic acid

About This Item

Molecular Formula	C₁₆H₂₂O₁₀
CAS Number	27741-01-1

FC-0969026

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Properties

Chemical Identifiers

IUPAC Name	(1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
SMILES	C1C=C([C@@H]2[C@H]1C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O)CO
InChI Key	ZJDOESGVOWAULF-OGJQONSISA-N
InChI	InChI=1S/C16H22O10/c17-3-6-1-2-7-8(14(22)23)5-24-15(10(6)7)26-16-13(21)12(20)11(19)9(4-18)25-16/h1,5,7,9-13,15-21H,2-4H2,(H,22,23)/t7-,9-,10-,11-,12+,13-,15+,16+/m1/s1

Physical Properties

Boiling Point	684.1±55.0 °C at 760 mmHg
Flash Point	250.9±25.0 °C
Density	1.6±0.1 g/cm3

Safety Information

Hazard Class

Warning

Flash Point

250.9±25.0 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.