6-O-p-Hydroxybenzoylaucubin

Modify Date: 2025-08-20 20:12:55

6-O-p-Hydroxybenzoylaucubin structure	Common Name	6-O-p-Hydroxybenzoylaucubin
	CAS Number	1016987-87-3	Molecular Weight	466.435
	Density	1.6±0.1 g/cm3	Boiling Point	762.8±60.0 °C at 760 mmHg
	Molecular Formula	C₂₂H₂₆O₁₁	Melting Point	N/A
	MSDS	N/A	Flash Point	265.3±26.4 °C

Name	(1S,4aR,5S,7aS)-1-(β-D-Glucopyranosyloxy)-7-(hydroxymethyl)-1,4a, 5,7a-tetrahydrocyclopenta[c]pyran-5-yl 4-hydroxybenzoate
Synonym	More Synonyms

Density	1.6±0.1 g/cm3
Boiling Point	762.8±60.0 °C at 760 mmHg
Molecular Formula	C₂₂H₂₆O₁₁
Molecular Weight	466.435
Flash Point	265.3±26.4 °C
Exact Mass	466.147522
PSA	175.37000
LogP	-0.77
Vapour Pressure	0.0±2.7 mmHg at 25°C
Index of Refraction	1.681
InChIKey	JZWZFNOVWZEQMF-QNAXTHAFSA-N
SMILES	O=C(OC1C=C(CO)C2C(OC3OC(CO)C(O)C(O)C3O)OC=CC12)c1ccc(O)cc1

Hazard Codes	Xi

Benzoic acid, 4-hydroxy-, (1S,4aR,5S,7aS)-1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-5-yl ester

(1S,4aR,5S,7aS)-1-(β-D-Glucopyranosyloxy)-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl 4-hydroxybenzoate

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