477578

Source:http://linkedlifedata.com/resource/chembl/compound/477578

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C16H26O7/c1-7-8(17)19-10-9(18-6)11-13(22-15(2,3)20-11)14-12(10)21-16(4,5)23-14/h9-14H,7H2,1-6H3/t9-,10-,11+,12+,13+,14+/m0/s1
chemicalCompound:standardIn...	QJDWMEHBLUXXHU-PRSXHHODSA-N
chemicalCompound:canonicalS...	CCC(=O)O[C@H]1[C@H](OC)[C@H]2OC(C)(C)O[C@H]2[C@@H]3OC(C)(C)O[C@H]13
chemicalCompound:molecularF...	C16H26O7
chemicalCompound:moleculeId	477578
chemicalCompound:mwFreebase	330.373
chemicalCompound:alogp	-0.14
chemicalCompound:hba	7
chemicalCompound:hbd	0
chemicalCompound:psa	72.45
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	1.726
chemicalCompound:acdLogD	1.726
chemicalCompound:fullMwt	330.373
chemicalCompound:chemblId	CHEMBL521662
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:577578
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:2282985