基本信息
- 标准SMILES
O=C(CCc1ccc(O)cc1)c1ccc(O)cc1O- InChIKey
UDGKKUWYNITJRX-UHFFFAOYSA-N- 分子式
- C15H14O4
- 平均分子量
- 258.27 g/mol
- 单同位素质量
- 258.08920893
概述
Davidigenin is a member of the class of dihydrochalcones that is dihydrochalcone substituted by hydroxy groups at positions 4, 2', and 4' respectively. It has a role as an antioxidant, a metabolite, an anti-allergic agent and an anti-asthmatic agent. It is a polyphenol and a member of dihydrochalcones. It is functionally related to a dihydrochalcone.
名称与标识
- 首选名称
- Davidigenin
- IUPAC
- 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one
- 中文名
- 2',4'-DIHYDROXY-3-(P-HYDROXYPHENYL)-PROPIOPHENONE
- 英文名
- 2',4'-Dihydroxy-3-(p-hydroxyphenyl)-propiophenone
- 分子式
- C15H14O4
- 分子量
- 258.27
名称与别名
Davidigenin23130-26-91-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one2',4,4'-TrihydroxydihydrochalconeIsoliquiritigenin metabolite M5OML9B432G44,2',4'-Trihydroxydihydrochalcone1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-1-propanone1-Propanone, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-CHEBI:27655DTXSID60331802RefChem:131023
展开更多名称
达维荚蒾苷元2',4,4'-Trihydroxydihydrochalcone 2',4'-Dihydroxy-3-(p-hydroxyphenyl)-propiophenone
DTXCID702828962',4'-Dihydroxy-3-(p-hydroxyphenyl)-propiophenoneCompound NP-007307UNII-OML9B432G4SCHEMBL750182CHEMBL192877orb3172284SCHEMBL30291870
数据库标识
- CAS
23130-26-9- PubChem CID
- 442342
- DTXSID
DTXSID60331802- ChEMBL
CHEMBL192877- ChEBI
CHEBI:27655- UNII
- OML9B432G4
- Nikkaji
- J23.023E
性质
结构计算性质
- XLogP
- 3
- 极性表面积
- 77.8 Ų
- 氢键供体
- 3
- 氢键受体
- 4
- 可旋转键
- 4
- 重原子
- 19
- 形式电荷
- 0
- 复杂度
- 297
实验与物化性质
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Chalcones and dihydrochalcones [PK1212]
物理化学性质
- 化妆品成分功效
- SKIN CONDITIONING
化学与工业
供应商3 家
深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
广州优南科技有限公司020-82000279 18988941452 · [email protected]
相关反应
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