VD2-D3
HIT212671654
sdf文件结构编辑类似物检索
HIT ID: HIT212671654
Cas No: 1217448-46-8
分子式: C28H44O
分子量: 399.677
常用名: VD2-D3
氢键受体数 (HBA): 1
氢键供体数 (HBD): 1
LogP: 7.050558
IUPAC: (1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-1-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene](1-2H)ethylidene}-4-(2H2)methylidenecyclohexan-1-ol
IUPAC: (1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-1-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene](1-2H)ethylidene}-4-(2H2)methylidenecyclohexan-1-ol
SMILES: [H][C@@]12[#6]-[#6]-[#6@H](-[#6@H](-[#6])\[#6]=[#6]\[#6@H](-[#6])-[#6](-[#6])-[#6])[C@@]1([#6])[#6]-[#6]-[#6]\[#6]2=[#6]/[#6](/[2H])=[#6]1/[#6]-[#6@@H](-[#8])-[#6]-[#6]/[#6]/1=[#6](/[2H])[2H]
SMILES: [H][C@@]12[#6]-[#6]-[#6@H](-[#6@H](-[#6])\[#6]=[#6]\[#6@H](-[#6])-[#6](-[#6])-[#6])[C@@]1([#6])[#6]-[#6]-[#6]\[#6]2=[#6]/[#6](/[2H])=[#6]1/[#6]-[#6@@H](-[#8])-[#6]-[#6]/[#6]/1=[#6](/[2H])[2H]
InChI key: MECHNRXZTMCUDQ-OQGZBSKRSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
165005日内发货 购物车
AA Blocks
BB
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