Name: trans-Miyabenol C
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218886700
Cas No:109605-83-6
常用名:trans-Miyabenol C
IUPAC:5-[(2R,3R)-6-hydroxy-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(1E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
IUPAC:5-[(2R,3R)-6-hydroxy-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(1E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
InChI key:RKFYYCKIHVEWHX-YOBICRQBSA-N

分子式:C42H32O9
分子量:680.709
氢键供体数 (HBD):7
氢键受体数 (HBA):
LogP:7.7
SMILES:[H][C@]1(Oc2cc(O)cc(c2[C@@]1([H])c1cc(O)cc(O)c1)[C@@]1([H])c2c(O[C@]1([H])c1ccc(O)cc1)cc(O)cc2\C=C\c1ccc(O)cc1)c1ccc(O)cc1
SMILES:[H][C@]1(Oc2cc(O)cc(c2[C@@]1([H])c1cc(O)cc(O)c1)[C@@]1([H])c2c(O[C@]1([H])c1ccc(O)cc1)cc(O)cc2\C=C\c1ccc(O)cc1)c1ccc(O)cc1

trans-Miyabenol C is a natural resveratrol trimer, acting as a protein kinase C inhibitor.

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