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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ether > aromatic ether > metocurine iodide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > metocurine iodide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > metocurine iodide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > metocurine iodide

Preferred term

metocurine iodide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C40H48I2N2O6
  • C40H48N2O6.2I

inchi

  • InChI=1S/C40H48N2O6.2HI/c1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36;;/h9-14,21-24,31-32H,15-20H2,1-8H3;2*1H/q+2;;/p-2/t31-,32+;;/m0../s1

inchikey

  • DIGFQJFCDPKEPF-OIUSMDOTSA-L

mass

  • 906.629

monoisotopicmass

  • 906.16018

smiles

  • [I-].[I-].C=12[C@@]3([N+](C)(CCC1C=C(C(=C2OC4=CC=C(C=C4)C[C@@]5([N+](CCC6=C5C=C(OC=7C(OC)=CC=C(C3)C7)C(=C6)OC)(C)C)[H])OC)OC)C)[H]

subset

  • 2_STAR

synonym EXACT

  • Metocurine iodide

synonym RELATED

  • Metubine iodide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:6901

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