
API0231922
Halcinonide
Halazepam is a benzodiazepine.
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CAS No.
3093-35-4
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Synonyms
halcinonide; 3093-35-4; Halcimat
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CHEMBL ID
CHEMBL1200845
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Indications
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Molecule Type
Small molecule
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Compound CID
443943
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Molecular Weight (g/mol)
455
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Molecular Formula
C24H32ClFO5
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InChI
InChI=1S/C24H32ClFO5/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,26)17(28)11-22(16,4)24(19,31-20)18(29)12-25/h9,15-17,19,28H,5-8,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1
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InChIKey
MUQNGPZZQDCDFT-JNQJZLCISA-N
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SMILES
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3C[C@@H]5[C@]4(OC(O5)(C)C)C(=O)CCl)C)O)F
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IUPAC Name
(1S,2S,4R,8S,9S,11S,12R,13S)-8-(2-chloroacetyl)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-16-one
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Exact Mass (Da)
454.19223
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Monoisotopic Mass (Da)
454.19223
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