2202

Source:http://linkedlifedata.com/resource/chembl/compound/2202

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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:2202_HYGROMYCIN A_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19-,20+,21-,23-/m1/s1
chemicalCompound:standardIn...	YQYJSBFKSSDGFO-IIHALWDASA-N
chemicalCompound:canonicalS...	CC(=O)[C@H]1O[C@@H](Oc2ccc(\C=C(/C)\C(=O)N[C@@H]3[C@H](O)[C@@H](O)[C@H]4OCO[C@H]4[C@@H]3O)cc2O)[C@@H](O)[C@@H]1O
chemicalCompound:molecularF...	C23 H29 N O12
chemicalCompound:moleculeId	2202
chemicalCompound:mwFreebase	511.476
chemicalCompound:alogp	-1.812
chemicalCompound:hba	12
chemicalCompound:hbd	7
chemicalCompound:psa	204.46
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	3
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	8.832
chemicalCompound:acdLogP	-0.328
chemicalCompound:acdLogD	-0.344
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	511.476
chemicalCompound:chemblId	CHEMBL267436
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:102202
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	HYGROMYCIN A
chemicalCompound:activity	activity:110037, activity:110038, activity:365479, activity:931934, activity:995824, activity:995825, activity:1234535, activity:1234536, activity:3523488, activity:3523489, activity:3523490, activity:3523491, activity:3523492, activity:3523493, activity:5168457, activity:5168460, activity:5168463, activity:5168466, activity:5168472, activity:5168478, activity:5168484, activity:5168485, activity:5168486, activity:5168487, activity:5168488, activity:5168489