Name: Napyradiomycin A1
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT214320723
Cas No:103106-24-7
常用名:Napyradiomycin A1
别名:Napyradiomycin A1
IUPAC:(3R,4aR,10aS)-3,4a-dichloro-10a-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-6,8-dihydroxy-2,2-dimethyl-2H,3H,4H,4aH,5H,10H,10aH-naphtho[2,3-b]pyran-5,10-dione
IUPAC:(3R,4aR,10aS)-3,4a-dichloro-10a-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-6,8-dihydroxy-2,2-dimethyl-2H,3H,4H,4aH,5H,10H,10aH-naphtho[2,3-b]pyran-5,10-dione
InChI key:BCPWMPCOEAOEDD-NQSCOFRMSA-N

分子式:C25H30Cl2O5
分子量:481.41
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6][C@@]12[#8]C([#6])([#6])[#6@H](Cl)-[#6][C@]1(Cl)[#6](=O)-c1c(-[#8])cc(-[#8])cc1-[#6]2=O
SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6][C@@]12[#8]C([#6])([#6])[#6@H](Cl)-[#6][C@]1(Cl)[#6](=O)-c1c(-[#8])cc(-[#8])cc1-[#6]2=O

Napyradiomycin A1is a fungal metabolite originally isolated fromC. rubraand has diverse biological activities.1,2It is active againstS. aureus,M. luteus,B. anthracis,C. bovis, andM. smegmatis(MICs = 1.56-12.5 μg/ml).1Napyradiomycin A1is an estrogen receptor antagonist (IC50= 4.2 μM in rat uterine homogenates).2It also inhibits mitochondrial NADH:ubiquinone oxidoreductase (complex I) and succinate:ubiquinone oxidoreductase (complex II) activities in bovine heart homogenates (IC50s = 20 and 9.7 μM, respectively).3

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