1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one (CHEBI:40148)

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CHEBI:40148 - 1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one

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ChEBI ID	CHEBI:40148
ChEBI Name	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one
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ASCII Name	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one
Last Modified	17 October 2009
Downloads	Molfile

Formula	C31H27F3N6O3
Net Charge	0
Average Mass	588.590
Monoisotopic Mass	588.20967
SMILES	[H]O[C@@]1([H])C([H])([H])N(C([H])([H])c2c([H])c([H])c([H])c([H])c2-c2c([H])c([H])c(N3C(=O)c4c(c(C(F)(F)F)nn4-c4c([H])c([H])c5onc(N([H])[H])c5c4[H])C([H])([H])C3([H])[H])c([H])c2[H])C([H])([H])C1([H])[H]
InChI	InChI=1S/C31H27F3N6O3/c32-31(33,34)28-24-12-14-39(30(42)27(24)40(36-28)21-9-10-26-25(15-21)29(35)37-43-26)20-7-5-18(6-8-20)23-4-2-1-3-19(23)16-38-13-11-22(41)17-38/h1-10,15,22,41H,11-14,16-17H2,(H2,35,37)/t22-/m1/s1
InChIKey	DFRIQJHMGZBFOM-JOCHJYFZSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one (CHEBI:40148) is a 1,2-benzoxazoles (CHEBI:51545)
	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one (CHEBI:40148) is a monohydroxypyrrolidine (CHEBI:46777)
	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one (CHEBI:40148) is a organofluorine compound (CHEBI:37143)
	1-(3-amino-1,2-benzoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one (CHEBI:40148) is a pyrazolopyridine (CHEBI:46699)

Synonyms	Source
1-(3-AMINO-1,2-BENZISOXAZOL-5-YL)-6-(2'-{[(3R)-3-HYDROXYPYRROLIDIN-1-YL]METHYL}BIPHENYL-4-YL)-3-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDRO-7H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE	PDBeChem
1-(3-amino-1,2-benzisoxazol-5-yl)-6-(2'-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}biphenyl-4-yl)-3-(trifluoromethyl)-1,4,5,6-tetrahydro-7H-pyrazolo[3,4-c]pyridin-7-one	PDBeChem

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