Products 163217-09-2
CAS 163217-09-2 appears in our catalog under these names: Inecalcitol, Inecalcitol, 99+%, Inecalcitol/ 99.77% (existing batch purity), Inecalcitol 99+%, Inecalcitol, 98.11%. Offered by: Chemat Brand, AmBeed, GLPBio, TargetMol, Biosynth. Available pack sizes: on request, 5g, 1mg, 10mg, 5mg, 25mg, 2mg, 50mg.
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.
| Molecular formula | C26H40O3 |
|---|---|
| Molecular weight | 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 |
| SMILES | C[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