methyl (1R,4aS,10aS)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate

• 常用名: methyl (1R,4aS,10aS)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate
• 英文名: methyl (1R,4aS,10aS)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate
• CAS号: 17751-36-9
• 分子量: 328.44500
• 密度: 1.074g/cm3
• 沸点: 434.9ºC at 760 mmHg
• 分子式: C₂₁H₂₈O₃
• 熔点: N/A
• 闪点: 187.9ºC

名称

• 英文名: methyl (1R,4aS,10aR)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate

物理化学性质

• 密度: 1.074g/cm3
• 沸点: 434.9ºC at 760 mmHg
• 分子式: C₂₁H₂₈O₃
• 分子量: 328.44500
• 闪点: 187.9ºC
• 精确质量: 328.20400
• PSA: 43.37000
• LogP: 4.63350
• InChIKey: URPBIQPJABGDJD-HMXCVIKNSA-N
• SMILES: COC(=O)C1(C)CCCC2(C)c3ccc(C(C)C)cc3C(=O)CC12
• 蒸汽压: 9.15E-08mmHg at 25°C
• 折射率: 1.527

靶点实验

查看更多实验

实验名称：Antimicrobial activity against Aspergillus niger CGMCC 3.316 after 48 hrs by modified... 来源：ChEMBL 靶标：Aspergillus niger External Id：CHEMBL1250939

实验名称：Antimicrobial activity against Candida albicans CGMCC 2.2086 after 48 hrs by modified... 来源：ChEMBL 靶标：Candida albicans External Id：CHEMBL1250938

实验名称：Antimicrobial activity against Trichophyton rubrum ATCC 10218 after 48 hrs by modifie... 来源：ChEMBL 靶标：Trichophyton rubrum External Id：CHEMBL1250937

实验名称：Antimicrobial activity against Pseudomonas fluorescens CGMCC 1.1828 after 24 hrs by m... 来源：ChEMBL 靶标：Pseudomonas fluorescens External Id：CHEMBL1250936

实验名称：Cytotoxicity against human KB cells 来源：ChEMBL 靶标：KB External Id：CHEMBL1009034

实验名称：Antimicrobial activity against Escherichia coli CGMCC 1.1571 after 24 hrs by modified... 来源：ChEMBL 靶标：Escherichia coli External Id：CHEMBL1250935

实验名称：Antimicrobial activity against Staphylococcus aureus CGMCC 1.1361 after 24 hrs by mod... 来源：ChEMBL 靶标：Staphylococcus aureus External Id：CHEMBL1250934

实验名称：HIV Cellular Data 来源：NIAID 靶标：N/A External Id：HIV Cellular Data

实验名称：Antimicrobial activity against Bacillus subtilis CGMCC 1.1162 after 24 hrs by modifie... 来源：ChEMBL 靶标：Bacillus subtilis External Id：CHEMBL1250933

实验名称：Antimicrobial activity against Candida tropicalis CGMCC2.3967 after 48 hrs by twofold... 来源：ChEMBL 靶标：Candida tropicalis External Id：CHEMBL3100399

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英文别名

• methyl 13-isopropyl-7-oxopodocarpe-8,11,13-trien-15-oate
• 13-isopropyl-7-oxopodocarpe-8,11,13-triene-15-carboxylic acid methyl ester
• Methyl 7-oxoabieta-9(11),8(14),12-trien-18-oate
• (1R,4AS,10aR)-7-Isopropyl-1,4a-dimethyl-9-oxo-1,2,3,4,4a,9,10,10a-octahydro-phenanthrene-1-carboxylic acid methyl ester
• 7-oxo-abieta-8,11,13-trien-18-oic acid methyl ester
• methyl 7-oxoabieta-8,11,13-trien-18-oate
• methyl 7-oxodehydroabietate
• 7-oxodehydroabietic acid methyl ester