
API0232756
Ketoconazole
Ketamine Hydrochloride is an anesthetic.
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CAS No.
65277-42-1
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Synonyms
ketoconazole; Panfungol; Ketoderm
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CHEMBL ID
CHEMBL295698
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Indications
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Molecule Type
Small molecule
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Compound CID
47576
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Molecular Weight (g/mol)
531.4
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Molecular Formula
C26H28Cl2N4O4
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InChI
InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m1/s1
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InChIKey
XMAYWYJOQHXEEK-ZEQKJWHPSA-N
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SMILES
CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC[C@@H]3CO[C@@](O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl
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IUPAC Name
1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
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Exact Mass (Da)
530.1487608
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Monoisotopic Mass (Da)
530.1487608
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