8(14)a-homocalcitriol
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8(14)a-homocalcitriol
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CAS No:
145459-22-9
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Formula:
C28H46O3
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Chemical Name:
8(14)a-homocalcitriol
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Synonyms:
(5Z,7E)-(1S,3R)-8(14a)-homo-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol;8(14)a-homocalcitriol;ZK 150123;ZK-150123;(5Z,7E)-(1S,3R)-8(14)a-homo-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol;1alpha,25-dihydroxy-8(14)a-homovitamin D3 / 1alpha,25-dihydroxy-8(14)a-homocholecalciferol;LMST03020347
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CAS No:
8(14)a-homocalcitriol Use and Manufacturing
Lipids -> Sterol Lipids [ST] -> Secosteroids [ST03] -> Vitamin D3 and derivatives [ST0302]
Computed Properties
Molecular Weight:430.7
XLogP3:5.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:430.34469533
Monoisotopic Mass:430.34469533
Topological Polar Surface Area:60.7
Heavy Atom Count:31
Complexity:703
Defined Atom Stereocenter Count:6
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes