Name: VD3-D6
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212671655
Cas No:118584-54-6
常用名:VD3-D6
别名:Vitamin D3-26,26,26,27,27,27-d6
IUPAC:(1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-(2H3)methyl(7,7,7-2H3)heptan-2-yl]-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexan-1-ol
IUPAC:(1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-(2H3)methyl(7,7,7-2H3)heptan-2-yl]-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexan-1-ol
InChI key:QYSXJUFSXHHAJI-HCXPDEKJSA-N

分子式:C27H44O
分子量:390.685
氢键供体数 (HBD):1
氢键受体数 (HBA):1
LogP:7.1254606
SMILES:[H][C@@]12CC[C@H]([C@H](C)CCCC(C([2H])([2H])[2H])C([2H])([2H])[2H])[C@@]1(C)CCC\C2=C/C=C1/C[C@@H](O)CCC1=C
SMILES:[H][C@@]12CC[C@H]([C@H](C)CCCC(C([2H])([2H])[2H])C([2H])([2H])[2H])[C@@]1(C)CCC\C2=C/C=C1/C[C@@H](O)CCC1=C

VD3-D6 is the deuterated form of Vitamin D3; tools for determination of Vitamin D3 metabolites in human serum.

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