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化合物简介
Totarol is a meroterpene, and more precisely a terpenophenolic, a chemical compound that is part terpene and part natural phenol. It is a naturally produced diterpene that is bioactive as (+)-totarol. It was first isolated by McDowell and Esterfield from the heartwood of Podocarpus totara, a yew tree found in New Zealand. Podocarpus totara was investigated for unique molecules due to the tree’s increased resistance to rotting. Recent studies have confirmed (+)-totarol’s unique antimicrobial and therapeutic properties. Consequently, (+)-totarol is a promising candidate for a new source of drugs and has been the goal of numerous syntheses.
基本信息
CAS:511-15-9
中文别名:桃柁酚;
英文别名:trans-Totarol;4b-S-trans-8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydro-1-isopropylphenanthren-2-ol;4BS TRANS,8,8-TRIMETHYL4B,5,6,7,8,8A,9,1;14-Isopropylpodocarpa-8,11,13-trien-13-ol;2-PHENANTHRENOL,4B,5,6,7,8,8A;Podocarpa-8,11,13-trien-13-ol,14-isopropyl;
分子式:C20H30O
分子量:286.452
精确质量:286.23
Psa:20.23
Logp:5.5458
中文别名:桃柁酚;
英文别名:trans-Totarol;4b-S-trans-8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydro-1-isopropylphenanthren-2-ol;4BS TRANS,8,8-TRIMETHYL4B,5,6,7,8,8A,9,1;14-Isopropylpodocarpa-8,11,13-trien-13-ol;2-PHENANTHRENOL,4B,5,6,7,8,8A;Podocarpa-8,11,13-trien-13-ol,14-isopropyl;
分子式:C20H30O
分子量:286.452
精确质量:286.23
Psa:20.23
Logp:5.5458
编号系统
物化性质
密度:0.988g/cm3
沸点:369.4ºC at 760mmHg
熔点:128-132ºC(lit.)
闪点:166.6ºC
折射率:1.529
沸点:369.4ºC at 760mmHg
熔点:128-132ºC(lit.)
闪点:166.6ºC
折射率:1.529
安全信息
安全说明:S26; S36
危险类别码:R36/37/38
危险品标志:Xi
危险类别码:R36/37/38
危险品标志:Xi
生产方法及用途
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
