Arctiin
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Arctiin
structure -
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CAS No:
20362-31-6
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Formula:
C27H34O11
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Chemical Name:
Arctiin
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Synonyms:
2(3H)-Furanone,4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-,(3R,4R)-;Arctiin;2(3H)-Furanone,4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-,(3R-trans)-;(3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-2(3H)-furanone;Arctigenin-4-glucoside;NSC 315527;Arctii;Arctin;27193-46-0
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CAS No:
Description
Arctiin(NSC 315527), a plant lignan that can be extracted from the Arctium lappa (burdock) seeds, is a possible environmental endocrine disruptor compounds and have been shown to influence sex hormone metabolism as well as protein synthesis, steroid biosynthesis. IC50 Value:Target: Othersin vitro: Treatment of PC-3 cells with arctiin decreased the cell number in a concentration- and time-dependent manner in serum-containing condition. Arctiin preferentially induced cell detachment, but d
Arctiin is a glycoside and a lignan.
Characteristics
153
1.8
White to off-white solid.
1.4±0.1 g/cm3
112 °C
756.4°C at 760 mmHg
250.1±26.4 °C
1.601
-20°C
4.79E-24mmHg at 25°C
Computed Properties
Molecular Weight:534.6
XLogP3:1.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:534.21011190
Monoisotopic Mass:534.21011190
Topological Polar Surface Area:153
Heavy Atom Count:38
Complexity:753
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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