4370

Source:http://linkedlifedata.com/resource/chembl/compound/4370

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:4370_ALPHA-LNA_TRADE_NAME, synonym:4370_LINOLENATE_TRADE_NAME, synonym:4370_LINOLENIC ACID_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-
chemicalCompound:standardIn...	DTOSIQBPPRVQHS-PDBXOOCHSA-N
chemicalCompound:canonicalS...	CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)O
chemicalCompound:molecularF...	C18H30O2
chemicalCompound:moleculeId	4370
chemicalCompound:mwFreebase	278.43
chemicalCompound:alogp	5.971
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	13
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.777
chemicalCompound:acdLogP	6.522
chemicalCompound:acdLogD	3.929
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	278.43
chemicalCompound:chemblId	CHEMBL8739
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:104370
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	LINOLENIC ACID
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:27432
chemicalCompound:activity	activity:791303, activity:1104718, activity:1104719, activity:2150479, activity:2193512, activity:2193523, activity:2193530, activity:2324044, activity:2324049, activity:2324067, activity:2324080, activity:2324083, activity:2325114, activity:2325120, activity:2325133, activity:2383144, activity:2383171, activity:2383198, activity:2383201, activity:2383206, activity:2383208, activity:2413749, activity:2539850, activity:2539861, activity:2539868, activity:2666400, activity:3607817, activity:3620622, activity:3640105, activity:3658011, activity:3675504, activity:3691808, activity:3693176, activity:3698425, activity:3717308, activity:3773543, activity:3774776, activity:3778887, activity:3894579, activity:3902824, activity:3919691, activity:3928646, activity:3929211, activity:3942329, activity:3951326, activity:3979719, activity:4004705, activity:4045655, activity:4045981, activity:4057189, activity:4106366, activity:4150679, activity:4155394, activity:4163000, activity:4215562, activity:4291443, activity:4296818, activity:4385566, activity:4386360, activity:4469596, activity:4503746, activity:4506513