Arctigenin 牛蒡子苷元
CAS 7770-78-7 MFCD00870597
化学结构图
SMILES: COc1cc(CC2C(=O)OCC2Cc2ccc(OC)c(OC)c2)ccc1O
化学属性
| Mol. Formula | C21 H24 O6 |
|---|---|
| Mol. Weight | 372.41 |
| Appearance | solid |
| Solubility | DMSO: 34 mg/mL with heating and sonicating, soluble |
| Density | 1.227 |
| Melting Point | 102 |
| Boiling Point | 567°C at 760mmHg |
| Flash Point | 198.8°C |
别名和识别编码
| Chemical Name | Arctigenin |
|---|---|
| Synonym | (3R)-3α-(3-Methoxy-4-hydroxybenzyl)-4β-(3,4-dimethoxybenzyl)-4,5-dihydrofuran-2(3H)-one (3R,4R)-3-(3-Methoxy-4-hydroxybenzyl)-4-(3,4-dimethoxybenzyl)tetrahydrofuran-2-one (3R,4R)-4-[(3,4-DIMETHOXYPHENYL)METHYL]DIHYDRO-3-[(4-HYDROXY-3-METHOXYPHENYL)METHYL]-2(3H)-FURANONE (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]tetrahydrofuran-2-one (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]dihydro-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]dihydro-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone, 2(3H)-Furanone 2(3H)-FURANONE,4-[(3,4-DIMETHOXYPHENYL)METHYL]DIHYDRO-3-[(4-HYDROXY-3-METHOXYPHENYL)METHYL]-,(3R,4R) 2(3H)-furanone, 4-((3,4-dimethoxyphenyl)methyl)dihydro-3-((4-hydroxy-3-methoxyphenyl)methyl)-, (3R-trans)- ARCTIGENIN ARCTIGENIN(P) Arctigenin {} {} {} |
| MDL Number | MFCD00870597 |
| PubChem Substance ID | 64981 |
| CAS Number | 7770-78-7 |
| Chemical Name Translation | 牛蒡子苷元 |
| Reaxys-RN | 4206071 |
| InChI | InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1 |
| LabNetwork Molecule ID | LN00383821 |
| Canonical SMILES | O=C1OC[C@H](CC2=CC=C(OC)C(OC)=C2)[C@H]1CC3=CC=C(O)C(OC)=C3 |
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相关文献及参考
- [2]. Gao Q, et, al. Overview of the anti-inflammatory effects, pharmacokinetic properties and clinical efficacies of arctigenin and arctiin from Arctium lappa L. Acta Pharmacol Sin. 2018 May;39(5):787-801.
- [3]. Hayashi K, et, al. Therapeutic effect of arctiin and arctigenin in immunocompetent and immunocompromised mice infected with influenza A virus. Biol Pharm Bull. 2010;33(7):1199-205.
- [4]. Wei L, et, al. Arctigenin Exerts Neuroprotective Effect by Ameliorating Cortical Activities in Experimental Autoimmune Encephalomyelitis In Vivo. Front Immunol. 2021 Jul 19;12:691590.
- [5]. Maxwell T, et, al. Arctigenin inhibits the activation of the mTOR pathway, resulting in autophagic cell death and decreased ER expression in ER-positive human breast cancer cells. Int J Oncol. 2018 Apr;52(4):1339-1349.
- [1]. Awale S, et, al. Identification of arctigenin as an antitumor agent having the ability to eliminate the tolerance of cancer cells to nutrient
安全信息
GHS Symbol
其他信息
- Sigma Aldrich:7770-78-7(sigmaaldrich)
- MOL 文件:7770-78-7.mol
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