Osajin
HIT100998070
sdf文件结构编辑类似物检索
HIT ID: HIT100998070
Cas No: 482-53-1
分子式: C25H24O5
分子量: 404.462
常用名: Osajin
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 5.4863
IUPAC: 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4H,8H-pyrano[2,3-h]chromen-4-one
IUPAC: 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4H,8H-pyrano[2,3-h]chromen-4-one
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])c2c(occ(-c3ccc(-[#8])cc3)c2=O)c2-[#6]=[#6]C([#6])([#6])[#8]-c12 |c:25|
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])c2c(occ(-c3ccc(-[#8])cc3)c2=O)c2-[#6]=[#6]C([#6])([#6])[#8]-c12 |c:25|
InChI key: DCTLJGWMHPGCOS-UHFFFAOYSA-N
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