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Substance Name: 6-Heptenoic acid, 7-(3-cyclopropyl-4-(4-fluorophenyl)-6-(1-methylethyl)-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)-3,5-dihydroxy-, monosodium salt
RN: 126274-06-4
InChIKey: JUANAWGOSZVIQF-WPDLWGESSA-M
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C31-H31-F-N3-O4.Na
Molecular Weight
- 551.5909
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Names and Synonyms
- 6-Heptenoic acid, 7-(3-cyclopropyl-4-(4-fluorophenyl)-6-(1-methylethyl)-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)-3,5-dihydroxy-, monosodium salt
Registry Numbers
CAS Registry Number
- 126274-06-4
System Generated Number
- 0126274064
Molecular Formulas
Molecular Formula
- C31-H31-F-N3-O4.Na
Molecular Formula Fragments
- C31-H31-F-N3-O4
- COMPONENT
- Na
Structure Descriptors
InChI
1S/C31H32FN3O4.Na/c1-18(2)29-25(15-14-23(36)16-24(37)17-26(38)39)27(19-10-12-21(32)13-11-19)28-30(20-8-9-20)34-35(31(28)33-29)22-6-4-3-5-7-22;/h3-7,10-15,18,20,23-24,36-37H,8-9,16-17H2,1-2H3,(H,38,39);/q;+1/p-1/b15-14+;InChIKey
JUANAWGOSZVIQF-WPDLWGESSA-MSmiles
CC(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD | oral | > 1gm/kg (1000mg/kg) | United States Patent Document. Vol. #5024999, |