43952

Source:http://linkedlifedata.com/resource/chembl/compound/43952

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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:43952_Hiserpia_TRADE_NAME, synonym:43952_Rau-sed_TRADE_NAME, synonym:43952_Reserpine_BAN, synonym:43952_Reserpine_FDA_ALTERNATIVE_NAME, synonym:43952_Reserpine_INN, synonym:43952_Reserpine_JAN, synonym:43952_Reserpine_TRADE_NAME, synonym:43952_Reserpine_USAN, synonym:43952_Reserpine_USP, synonym:43952_Sandril_TRADE_NAME, synonym:43952_Serpalan_TRADE_NAME, synonym:43952_Serpanray_TRADE_NAME, synonym:43952_Serpasil_TRADE_NAME, synonym:43952_Serpate_TRADE_NAME, synonym:43952_Serpivite_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1
chemicalCompound:standardIn...	QEVHRUUCFGRFIF-MDEJGZGSSA-N
chemicalCompound:canonicalS...	CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c6cc(OC)c(OC)c(OC)c6
chemicalCompound:molecularF...	C33H40N2O9
chemicalCompound:moleculeId	43952
chemicalCompound:mwFreebase	608.679
chemicalCompound:alogp	4.242
chemicalCompound:hba	10
chemicalCompound:hbd	1
chemicalCompound:psa	117.78
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.447
chemicalCompound:acdLogD	4.215
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	608.679
chemicalCompound:acdMostBpk...	7.25
chemicalCompound:chemblId	CHEMBL772
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:143952
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	RESERPINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:28487
chemicalCompound:activity	activity:72924, activity:185265, activity:185266, activity:185267, activity:185268, activity:185269, activity:185270, activity:185271, activity:185272, activity:185273, activity:185274, activity:185275, activity:185276, activity:185277, activity:185278, activity:185279, activity:185280, activity:185281, activity:201647, activity:201648, activity:201649, activity:201650, activity:219178, activity:219179, activity:219180, activity:219181, activity:366988, activity:366989, activity:366990, activity:366991, activity:383642, activity:383643, activity:997428, activity:997429, activity:1304210, activity:1304211, activity:1847080, activity:1847081, activity:1847082, activity:1847083, activity:1847084, activity:1847085, activity:1847086, activity:1847087, activity:1847088, activity:1847089, activity:1847090, activity:1847091, activity:1847092, activity:1847093