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

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类似物检索

HIT ID:HIT212673205
Cas No:2070009-38-8
常用名:Maxacalcitol-D6
IUPAC:(1R,3S,5Z)-5-{2-[(1S,3aS,4E,7aS)-1-[(1S)-1-[3-hydroxy-3-(2H3)methyl(4,4,4-2H3)butoxy]ethyl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
IUPAC:(1R,3S,5Z)-5-{2-[(1S,3aS,4E,7aS)-1-[(1S)-1-[3-hydroxy-3-(2H3)methyl(4,4,4-2H3)butoxy]ethyl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
InChI key:DTXXSJZBSTYZKE-OXMAATCFSA-N

分子式:C26H42O4
分子量:424.655
氢键供体数 (HBD):3
氢键受体数 (HBA):4
LogP:2.7929602
SMILES:[H][C@@]12CC[C@H]([C@H](C)OCCC(O)(C([2H])([2H])[2H])C([2H])([2H])[2H])[C@@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](O)C1=C
SMILES:[H][C@@]12CC[C@H]([C@H](C)OCCC(O)(C([2H])([2H])[2H])C([2H])([2H])[2H])[C@@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](O)C1=C

Maxacalcitol-D6 is a non-calcemic vitamin D3 analog and VDR ligand of VDR-like receptors.Maxacalcitol-D6 is the deuterated form of Maxacalcitol (22-Oxacalcitriol).

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