Arctiin

About This Item

Molecular Formula	C₂₇H₃₄O₁₁
CAS Number	20362-31-6

FC-0209487

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Properties

Chemical Identifiers

IUPAC Name	(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one
SMILES	COC1=C(C=C(C=C1)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC)OC
InChI Key	XOJVHLIYNSOZOO-SWOBOCGESA-N
InChI	InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3/t16-,17+,22+,23+,24-,25+,27+/m0/s1

Physical Properties

Boiling Point	756.4±60.0 °C at 760 mmHg
Flash Point	250.1±26.4 °C
Density	1.4±0.1 g/cm3

Safety Information

Flash Point

250.1±26.4 °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.