Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Gancaonin I
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Purity: 97.0%
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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Gancaonin I
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Purity: 98.0%
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126716-36-7

126716-36-7 structure

126716-36-7 structure

Name: Gancaonin I
Chemical Name: gancaonin I
CAS Number: 126716-36-7
Molecular Formula: C₂₁H₂₂O₅
Molecular Weight: 354.396
Catalog: Natural product Phenols
Create Date: 2017-04-12 14:40:56
Modify Date: 2025-08-26 12:04:14
Gancaonin I, an Isoflavone, exhibits moderate inhibition on human carboxylesterase 2 (hCES2A) with IC50 of 1.72 μM. Gancaonin I inhibits hCES2A-mediated fluorescein diacetate (FD) hydrolysis[1].

Name	gancaonin I
Synonyms	4-[4,6-Dimethoxy-5-(3-methyl-2-buten-1-yl)-1-benzofuran-2-yl]-1,3-benzenediol 4-[4,6-dimethoxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol 1,3-Benzenediol, 4-[4,6-dimethoxy-5-(3-methyl-2-buten-1-yl)-2-benzofuranyl]- 4-[4,6-Dimethoxy-5-(3-methyl-but-2-enyl)-benzofuran-2-yl]-benzene-1,3-diol Gancaonin I 4-(4,6-Dimethoxy-5-(3-methyl-but-2-enyl)-benzofuran-2-yl)-benzene-1,3-diol 4-[4,6-dimethoxy-5-(3-methylbut-2-enyl)-1-benzofuran-2-yl]benzene-1,3-diol

Description	Gancaonin I, an Isoflavone, exhibits moderate inhibition on human carboxylesterase 2 (hCES2A) with IC50 of 1.72 μM. Gancaonin I inhibits hCES2A-mediated fluorescein diacetate (FD) hydrolysis[1].
Related Catalog	Research Areas >> Cancer Signaling Pathways >> Others >> Others
References	[1]. Yun-Qing Song, et al. Discovery of hCES2A inhibitors from Glycyrrhiza inflate via combination of docking-based virtual screening and fluorescence-based inhibition assays. Food Funct. 2021 Jan 7;12(1):162-176.

Density	1.2±0.1 g/cm3
Boiling Point	534.2±45.0 °C at 760 mmHg
Molecular Formula	C₂₁H₂₂O₅
Molecular Weight	354.396
Flash Point	276.9±28.7 °C
Exact Mass	354.146729
PSA	72.06000
LogP	4.45
Vapour Pressure	0.0±1.5 mmHg at 25°C
Index of Refraction	1.611

Hazard Codes	Xi

129280-36-0 structure

129280-36-0

~%

126716-36-7 structure

126716-36-7

Literature: Kiuchi, Fumiyuki; Chen, Xing; Tsuda, Yoshisuke Heterocycles, 1990 , vol. 31, # 4 p. 629 - 636

Precursor 1
129280-36-0
DownStream 0

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