Name: TLR4/NF-κB/MAPK-IN-1
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218963706
Cas No:2767567-26-8
常用名:TLR4/NF-κB/MAPK-IN-1
IUPAC:(4S)-4-[(3aR,4S,7aR)-4-(acetyloxy)-6-(bromomethyl)-3-methylidene-2-oxo-2,3,3a,4,7,7a-hexahydro-1-benzofuran-5-yl]pentyl acetate
IUPAC:(4S)-4-[(3aR,4S,7aR)-4-(acetyloxy)-6-(bromomethyl)-3-methylidene-2-oxo-2,3,3a,4,7,7a-hexahydro-1-benzofuran-5-yl]pentyl acetate
InChI key:JLDQUFKUAFNISU-QMHBMSAFSA-N

分子式:C19H25BrO6
分子量:429.307
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CC(CBr)=C([C@@H](C)CCCOC(C)=O)[C@@H](OC(C)=O)[C@]1([H])C(=C)C(=O)O2
SMILES:[H][C@@]12CC(CBr)=C([C@@H](C)CCCOC(C)=O)[C@@H](OC(C)=O)[C@]1([H])C(=C)C(=O)O2

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