63252

Source:http://linkedlifedata.com/resource/chembl/compound/63252

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Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:63252_1alpha,25-dihydroxycholecalciferol_OTHER, synonym:63252_1alpha,25-dihydroxyvitamin D3_OTHER, synonym:63252_Calcijex_TRADE_NAME, synonym:63252_Calcitriol_BAN, synonym:63252_Calcitriol_FDA_ALTERNATIVE_NAME, synonym:63252_Calcitriol_INN, synonym:63252_Calcitriol_JAN, synonym:63252_Calcitriol_TRADE_NAME, synonym:63252_Calcitriol_USAN, synonym:63252_Dihydroxycholecalciferol_TRADE_NAME, synonym:63252_Dihydroxyvitamin D 3_TRADE_NAME, synonym:63252_Ro-21-5535_RESEARCH_CODE, synonym:63252_Rocaltrol_TRADE_NAME, synonym:63252_Topitriol_TRADE_NAME, synonym:63252_Vectical_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1
chemicalCompound:standardIn...	GMRQFYUYWCNGIN-NKMMMXOESA-N
chemicalCompound:canonicalS...	C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)C[C@H](O)C3=C)\CCC[C@]12C
chemicalCompound:molecularF...	C27H44O3
chemicalCompound:moleculeId	63252
chemicalCompound:mwFreebase	416.636
chemicalCompound:alogp	5.179
chemicalCompound:hba	3
chemicalCompound:hbd	3
chemicalCompound:psa	60.69
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.632
chemicalCompound:acdLogD	5.632
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	416.636
chemicalCompound:chemblId	CHEMBL846
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:163252
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	Yes
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	CALCITRIOL
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:17823
chemicalCompound:activity	activity:75379, activity:75380, activity:75381, activity:75382, activity:75383, activity:75384, activity:99010, activity:115343, activity:115344, activity:115345, activity:115346, activity:142134, activity:156954, activity:156955, activity:249106, activity:249107, activity:249108, activity:249109, activity:249110, activity:296379, activity:296380, activity:385329, activity:385330, activity:385331, activity:392446, activity:392447, activity:392448, activity:392449, activity:392450, activity:392451, activity:513633, activity:613892, activity:613893, activity:636627, activity:636628, activity:636629, activity:636630, activity:636631, activity:636632, activity:636633, activity:636634, activity:636635, activity:636636, activity:754680, activity:754681, activity:754682, activity:754683, activity:754684, activity:764510, activity:764511, activity:813772