Name: Rifapentine
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212083280
Cas No:61379-65-5
常用名:Rifapentine
别名:利福喷丁, Rifapentinum, Rifapentina, Priftin, MDL473, DL 473, Cyclopentylrifampicin
别名:利福喷丁, Rifapentinum, Rifapentina, Priftin, MDL473, DL 473, Cyclopentylrifampicin
IUPAC:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-26-[(E)-[(4-cyclopentylpiperazin-1-yl)imino]methyl]-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
IUPAC:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-26-[(E)-[(4-cyclopentylpiperazin-1-yl)imino]methyl]-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
InChI key:WDZCUPBHRAEYDL-NAFQJNKLSA-N

分子式:C47H64N4O12
分子量:877.045
氢键供体数 (HBD):6
氢键受体数 (HBA):14
LogP:3.5568845
SMILES:CO[C@H]1\C=C/O[C@@]2(C)Oc3c(C2=O)c2c(O)c(\C=N\N4CCN(CC4)C4CCCC4)c(NC(=O)\C(C)=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(O)c2c(O)c3C |c:3,38,40|
SMILES:CO[C@H]1\C=C/O[C@@]2(C)Oc3c(C2=O)c2c(O)c(\C=N\N4CCN(CC4)C4CCCC4)c(NC(=O)\C(C)=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(O)c2c(O)c3C |c:3,38,40|

Rifapentine (Standard) 是一种可用于分析的标准物质，通常用作 Rifapentine 的研究和分析中参考的标准样品。Rifapentine (Rifapentinum) 是可用于肺结核的抗生素。

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