Inecalcitol

cas: 163217-09-2 — see every product listed under this CAS number, including other names

Inecalcitol (CAS 163217-09-2) is a chemical reagent available from Chemat. Available pack sizes: on request, 1mg, 10mg, 5mg, 2mg, 25mg. Offered by: Chemat Brand, GLPBio, Biosynth, Chemat.

brandChemat Brand
catalog numberRM-I141200
cas163217-09-2
sizeon request
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Available pack sizes

brand size price
Chemat Brand on request price on request
GLPBio 1mg 3152.59 Pln
GLPBio 10mg 13051.85 Pln
GLPBio 5mg 7996.91 Pln
Biosynth 1mg price on request
Biosynth 2mg price on request
Biosynth 5mg price on request
Chemat 1mg 357.20 Pln
Chemat 5mg 789.20 Pln
Chemat 10mg 1307.60 Pln
Chemat 25mg 2901.20 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Trans-(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol (CAS 163217-09-2) is a chemical compound with the molecular formula C26H40O3 and a molecular weight of 400.6 g/mol. IUPAC name: trans-(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol. InChIKey: HHGRMHMXKPQNGF-WNSNRMDMSA-N.

Identity
Molecular formulaC26H40O3
Molecular weight400.6 g/mol
IUPAC nametrans-(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
InChIKeyHHGRMHMXKPQNGF-WNSNRMDMSA-N
SMILESC[C@H](CC#CC(C)(C)O)[C@H]1CC[C@H]\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C

Computed by PubChem (NCBI)

Synonyms: Inecalcitol, (7E)-19-Nor-9,10-seco-14beta-cholesta-5,7-dien-23-yne-1alpha,3beta,25-triol, (7E)-19-nor-9,10-seco-14bet-cholesta-5,7-dien-23-yne-, 1alpha, 3beta, 25-triol, INECALCITOLUM, Inecalcitol [INN], 19-Nor-14-epi-23-yne-1,25 dihydroxyvitamin D3, (7E)-(1R,3R,14R)-19-nor-23-yne-9,10-seco-5,7-cholestadiene-1,3,25-triol, orb1305513, 9,10-seco-14bh-19-norcholesta-5(z),7(e)-dien-1(r),3(r),25-triol-23-yne
Isomers (same molecular formula)
[(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] octanoate C26H40O3

Also listed as

Inecalcitol, 99+% AmBeed CAS 163217-09-2
Inecalcitol/ 99.77% (existing batch purity) TargetMol CAS 163217-09-2
Inecalcitol 99+% Ambeed CAS 163217-09-2
Inecalcitol, 98.11% MedChemExpress CAS 163217-09-2