Name: Talaromycesone A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214322140
Cas No:1658474-60-2
常用名:Talaromycesone A
IUPAC:(1R,2R,13S,14S,24S)-5,9,19-trihydroxy-13-methoxy-11,17-dimethyl-7,15,21-trioxo-6,22-dioxaheptacyclo[12.9.1.1^{1,16}.1^{4,8}.0^{2,13}.0^{12,26}.0^{20,25}]hexacosa-4,8,10,12(26),16(25),17,19-heptaen-24-yl acetate
IUPAC:(1R,2R,13S,14S,24S)-5,9,19-trihydroxy-13-methoxy-11,17-dimethyl-7,15,21-trioxo-6,22-dioxaheptacyclo[12.9.1.1^{1,16}.1^{4,8}.0^{2,13}.0^{12,26}.0^{20,25}]hexacosa-4,8,10,12(26),16(25),17,19-heptaen-24-yl acetate
InChI key:YIZTWZUVIZZEGP-CFFYBBSFSA-N

分子式:C29H24O11
分子量:548.5
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12Cc3c(O)oc(=O)c4c(O)cc(C)c(c34)[C@@]1(OC)[C@]1([H])[C@H](OC(C)=O)[C@]22COC(=O)c3c(O)cc(C)c(C1=O)c23 |THB:23:22:1.17:39.38.41|
SMILES:[H][C@]12Cc3c(O)oc(=O)c4c(O)cc(C)c(c34)[C@@]1(OC)[C@]1([H])[C@H](OC(C)=O)[C@]22COC(=O)c3c(O)cc(C)c(C1=O)c23 |THB:23:22:1.17:39.38.41|

Talaromycesone A is a fungal metabolite originally isolated fromTalaromyces.1It is active againstS. epidermidisand methicillin-resistantS. aureus(MRSA) bacteria (IC50s = 3.70 and 5.48 μM, respectively). Talaromycesone A inhibits acetylcholinesterase (AChE) in a cell-free assay (IC50= 7.49 μM for the human enzyme).

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