Name: Vitamin D3 octanoate
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT214324181
Cas No:927822-16-0
常用名:Vitamin D3 octanoate
别名:Vitamin D3 octanoate
IUPAC:(1S,3E)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexyl octanoate
IUPAC:(1S,3E)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexyl octanoate
InChI key:ARPKBLFKZDOQKT-XLATZHIHSA-N

分子式:C35H58O2
分子量:510.847
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1/C[C@H](CCC1=C)OC(=O)CCCCCCC)[C@H](C)CCCC(C)C
SMILES:[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1/C[C@H](CCC1=C)OC(=O)CCCCCCC)[C@H](C)CCCC(C)C

Vitamin D3 octanoate, an ester derived from vitamin D3, is commonly known as cholecalciferol. Cholecalciferol is a naturally occurring form of vitamin D with notable properties such as inducing cell differentiation and impeding cancer cell proliferation.

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