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Maxacalcitol-[d6]

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General Information
Catalog: BLP-013523
Molecular Formula: C26H36D6O4
Molecular Weight: 424.65

Chemical Structure

Description	Labelled Maxacalcitol. Maxacalcitol is non-calcemic vitamin D3 analog and ligand of VDR-like receptors.
Synonyms	22-Oxacalcitriol-d6
IUPAC Name	(1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-7a-methyl-1-[(1S)-1-[4,4,4-trideuterio-3-hydroxy-3-(trideuteriomethyl)butoxy]ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Related CAS	103909-75-7 (unlabelled)
Canonical SMILES	CC(C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C)OCCC(C)(C)O
InChI	InChI=1S/C26H42O4/c1-17-20(15-21(27)16-24(17)28)9-8-19-7-6-12-26(5)22(10-11-23(19)26)18(2)30-14-13-25(3,4)29/h8-9,18,21-24,27-29H,1,6-7,10-16H2,2-5H3/b19-8+,20-9-/t18-,21+,22+,23-,24-,26+/m0/s1/i3D3,4D3
InChI Key	DTXXSJZBSTYZKE-OXMAATCFSA-N
Purity	>98%