430124

Source:http://linkedlifedata.com/resource/chembl/compound/430124

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Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:430124_Calciferol_OTHER, synonym:430124_Calciferol_TRADE_NAME, synonym:430124_Deltalin_TRADE_NAME, synonym:430124_Drisdol_TRADE_NAME, synonym:430124_Ergocalciferol_BAN, synonym:430124_Ergocalciferol_FDA_ALTERNATIVE_NAME, synonym:430124_Ergocalciferol_INN, synonym:430124_Ergocalciferol_JAN, synonym:430124_Ergocalciferol_USAN, synonym:430124_Ergocalciferol_USP, synonym:430124_Oleovitamin D, Synthetic_OTHER, synonym:430124_Oleovitamin D_TRADE_NAME, synonym:430124_Viosterol in Oil_OTHER, synonym:430124_Vitamin D 2_TRADE_NAME, synonym:430124_Vitamin D2_OTHER, synonym:430124_Vitamin d_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12+,24-13-/t20-,22+,25-,26+,27-,28+/m0/s1
chemicalCompound:standardIn...	MECHNRXZTMCUDQ-RKHKHRCZSA-N
chemicalCompound:canonicalS...	CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C
chemicalCompound:molecularF...	C28H44O
chemicalCompound:moleculeId	430124
chemicalCompound:mwFreebase	396.648
chemicalCompound:alogp	7.563
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	20.23
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	9.148
chemicalCompound:acdLogD	9.148
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	396.648
chemicalCompound:chemblId	CHEMBL1536
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:530124
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	ERGOCALCIFEROL
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:28934
chemicalCompound:activity	activity:2127934, activity:2127943, activity:2127946, activity:2127950, activity:2127955, activity:2127958, activity:2127964, activity:4310993, activity:4673435, activity:5316223, activity:5316603, activity:5385675, activity:5662107, activity:5762792, activity:6261142, activity:7150305, activity:7564991, activity:7566019, activity:7566020, activity:7658513, activity:7658514, activity:7658515, activity:7658516, activity:7658517, activity:7658518, activity:7658519, activity:7658520, activity:7658521, activity:7658522, activity:7658523, activity:7658524, activity:7658525, activity:7658526, activity:7658527, activity:7658528, activity:7658529, activity:7658530, activity:7658531, activity:7658532, activity:7658533, activity:7658534, activity:7658535, activity:7658536, activity:7658537, activity:7658538, activity:7658539, activity:7658540, activity:7658541, activity:7658542, activity:7658543