API0232527
Naltrexone
Naltrexone Hydrochloride is an opioid antagonist used for alcohol dependence.
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CAS No.
16590-41-3
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Synonyms
naltrexone; 16590-41-3; Vivitrex
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CHEMBL ID
CHEMBL19019
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Molecule Type
Small molecule
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Compound CID
5360515
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Molecular Weight (g/mol)
341.4
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Molecular Formula
C20H23NO4
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InChI
InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1
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InChIKey
DQCKKXVULJGBQN-XFWGSAIBSA-N
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SMILES
C1CC1CN2CC[C@]34[C@@H]5C(=O)CC[C@]3([C@H]2CC6=C4C(=C(C=C6)O)O5)O
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IUPAC Name
(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
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Exact Mass (Da)
341.16270821
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Monoisotopic Mass (Da)
341.16270821
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