API0232701
Penbutolol Sulfate
Pemoline is a central nervous system stimulant, withdrawn.
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CAS No.
38363-32-5
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Synonyms
PENBUTOLOL SULFATE; 38363-32-5; Levatol
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CHEMBL ID
CHEMBL2361370
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Compound CID
38010
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Molecular Weight (g/mol)
680.9
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Molecular Formula
C36H60N2O8S
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InChI
InChI=1S/2C18H29NO2.H2O4S/c2*1-18(2,3)19-12-15(20)13-21-17-11-7-6-10-16(17)14-8-4-5-9-14;1-5(2,3)4/h2*6-7,10-11,14-15,19-20H,4-5,8-9,12-13H2,1-3H3;(H2,1,2,3,4)/t2*15-;/m00./s1
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InChIKey
FEDSNBHHWZEYTP-ZFQYHYQMSA-N
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SMILES
CC(C)(C)NC[C@@H](COC1=CC=CC=C1C2CCCC2)O.CC(C)(C)NC[C@@H](COC1=CC=CC=C1C2CCCC2)O.OS(=O)(=O)O
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IUPAC Name
(2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)propan-2-ol;sulfuric acid
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Exact Mass (Da)
680.40703805
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Monoisotopic Mass (Da)
680.40703805
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