Name: Ophiobolin B
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212741341
Cas No:5601-74-1
常用名:Ophiobolin B
别名:蛇孢假壳素B
IUPAC:(1R,3S,4R,7S,11R,12S)-4,12-dihydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.0^{3,7}]tetradec-8-ene-8-carbaldehyde
IUPAC:(1R,3S,4R,7S,11R,12S)-4,12-dihydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.0^{3,7}]tetradec-8-ene-8-carbaldehyde
InChI key:SXRLPRKYTRWOES-OTRLCWIBSA-N

分子式:C25H38O4
分子量:402.575
氢键供体数 (HBD):2
氢键受体数 (HBA):4
LogP:3.6043644
SMILES:[#6]-[#6@@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[C@@]1([#8])[#6]-[#6][C@]2([#6])[#6]-[#6@H]3-[#6@H](-[#6](=O)-[#6][C@@]3([#6])[#8])-[#6](-[#6]=O)=[#6]-[#6]-[#6@@H]12 |w:26.27|
SMILES:[#6]-[#6@@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[C@@]1([#8])[#6]-[#6][C@]2([#6])[#6]-[#6@H]3-[#6@H](-[#6](=O)-[#6][C@@]3([#6])[#8])-[#6](-[#6]=O)=[#6]-[#6]-[#6@@H]12 |w:26.27|

Ophiobolin B is a sesterterpene Helminthosporium oryzae metabolite, inhibits proton extrusion from maize coleoptiles.

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