Chemical Compound

Inecalcitol

CAS Registry Number 163217-09-2
Inecalcitol chemical structure
Primary Record

Inecalcitol

In stock
5,966 g
Purity
99.7 %
CAS
163217-09-2

Compound Identifiers & Properties

CAS
163217-09-2
PubChem CID
6915835
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
Canonical SMILES
C[C@H](CC#CC(C)(C)O)[C@H]1CC[C@@H]2/C(=C/C=C3C[C@@H](O)C[C@H](O)C3)CCC[C@@]21C

Names & Synonyms

  • Inecalcitol
  • Inecalcitol [INN]
  • Inecalcitol oral
  • TX-522
  • TX527 cpd
  • 163217-09-2
  • INECALCITOLUM
  • AC1OCD0K
  • RefChem:148255
  • TX 522
  • UNII-05FZV98342
  • D00CPS
  • D0R8IE
  • TX-527
  • Vitamin D analogs, KULeuven
  • SCHEMBL754593
  • DTXSID60870084
  • GTPL7747
  • orb1305513
  • 05FZV98342
  • CHEMBL2105107
  • TX 527
  • DTXCID001511070
  • GLXC-05014
  • TX522
  • C26H40O3
  • EX-A5555
  • 8151AH
  • LMST03020649
  • ZINC12504514
  • AKOS025312295
  • AN-7569
  • CID6915835
  • DB04796
  • 19-Nor-14-epi-23-yne-1,25 dihydroxyvitamin D3
  • CID:6915835
  • HY-32344
  • Inecalcitol (sc, psoriasis), Hybrigenics
  • MS-26815
  • SID:134222765
  • (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
  • CS-0001525
  • NS00070816
  • J1.322.262B
  • G13594
  • Vitamin D analog (sc, psoriasis), Hybrigenics
  • Inecalcitol (oral, hyperthyroidism), Hybrigenics
  • Vitamin D analogs, Catholic University of Leuven
  • A936500
  • C409043
  • Q27078058
  • (7E)-19-Nor-9,10-seco-14beta-cholesta-5,7-dien-23-yne-1alpha,3beta,25-triol
  • B2693-453195
  • Inecalcitol (oral, prostate cancer/psoriasis), Hybrigenics
  • (7E)-(1R,3R,14R)-19-nor-23-yne-9,10-seco-5,7-cholestadiene-1,3,25-triol
  • (7E)-19-nor-9,10-seco-14bet-cholesta-5,7-dien-23-yne-, 1alpha, 3beta, 25-triol
  • 19-NOR-14-EPI-23-YNE-1,25 DIHYDROXYVITAMIN D3, TX522
  • 9,10-seco-14bh-19-norcholesta-5(z),7(e)-dien-1(r),3(r),25-triol-23-yne
  • (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
  • (1R,3R)-5-((E)-2-((1R,3AR,7aR)-1-((R)-6-Hydroxy-6-methylhept-4-yn-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)cyclohexane-1,3-diol
  • (1R,3R)-5-(2-((1R,3aR,7aR,E)-1-((R)-6-hydroxy-6-methylhept-4-yn-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)cyclohexane-1,3-diol
  • (1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(1R)-5-hydroxy-1,5-dimethyl-hex-3-ynyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
  • (1R,3R)-5-{2-[(1R,3aR,4E,7aR)-1-[(2R)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}cyclohexane-1,3-diol
  • (1R,3R,7E)-17beta-[(2R)-6-Hydroxy-6-methylhept-4-yn-2-yl]-14beta-9,10-secoestra-5,7-diene-1,3-diol
  • (3abeta)-Octahydro-1beta-[(1R)-1,5-dimethyl-5-hydroxy-3-hexynyl]-7abeta-methyl-4-[(1E)-2-(3beta,5alpha-dihydroxycyclohexane-1-ylidene)ethylidene]-1H-indene
  • (7E)-19-NOR-9,10-SECO-14.BETA.-CHOLESTA-5,7-DIEN-23-YNE-1.ALPHA.,3.BETA.,25-TRIOL
  • 1,3-CYCLOHEXANEDIOL, 5-((2E)-2-((1R,3AR,7AR)-OCTAHYDRO-1-((1R)-5-HYDROXY-1,5-DIMETHYL-3-HEXYN-1-YL)-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-, (1R,3R)-