API0231558
Eplerenone
Epirubicin Hydrochloride is an anticancer drug.
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CAS No.
107724-20-9
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Synonyms
Eplerenone; Selara; SC-66110
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CHEMBL ID
CHEMBL1095097
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Molecule Type
Small molecule
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Compound CID
443872
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Molecular Weight (g/mol)
414.5
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Molecular Formula
C24H30O6
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InChI
InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3/t15-,16+,17-,19+,21+,22+,23-,24-/m1/s1
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InChIKey
JUKPWJGBANNWMW-VWBFHTRKSA-N
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SMILES
C[C@]12CCC(=O)C=C1C[C@H]([C@@H]3[C@]24[C@H](O4)C[C@]5([C@H]3CC[C@@]56CCC(=O)O6)C)C(=O)OC
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IUPAC Name
methyl (1R,2S,9R,10R,11S,14R,15S,17R)-2,15-dimethyl-5,5'-dioxospiro[18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadec-6-ene-14,2'-oxolane]-9-carboxylate
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Exact Mass (Da)
414.20423867
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Monoisotopic Mass (Da)
414.20423867
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