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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > vinca alkaloid cation > 11-o-demethyl-17-o-deacetylvindolinium(1+)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > vinca alkaloid cation > 11-o-demethyl-17-o-deacetylvindolinium(1+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > vinca alkaloid cation > 11-o-demethyl-17-o-deacetylvindolinium(1+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > vinca alkaloid cation > 11-o-demethyl-17-o-deacetylvindolinium(1+)

Preferred term

11-o-demethyl-17-o-deacetylvindolinium(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C22H29N2O5

inchi

  • InChI=1S/C22H28N2O5/c1-4-20-8-5-10-24-11-9-21(16(20)24)14-7-6-13(25)12-15(14)23(2)17(21)22(28,18(20)26)19(27)29-3/h5-8,12,16-18,25-26,28H,4,9-11H2,1-3H3/p+1/t16-,17+,18+,20+,21+,22-/m0/s1

inchikey

  • MNCVVTFLNVITRD-RLFCDOPRSA-O

is_conjugate_acid_of

mass

  • 401.477

monoisotopicmass

  • 401.20710

smiles

  • [C@@]123[C@@](N(C4=C1C=CC(=C4)O)C)([C@]([C@@H]([C@]5([C@@]2([NH+](CC=C5)CC3)[H])CC)O)(C(=O)OC)O)[H]

subset

  • 3_STAR

synonym EXACT

  • 3beta,4beta,16-trihydroxy-3alpha-(methoxycarbonyl)-1-methyl-6,7-didehydro-2beta, 5alpha,12beta,19alpha-aspidospermidin-9-ium

synonym RELATED

  • 11-O-demethyl-17-O-deacetylvindolinium cation
  • 4-O-deacetyl-16-O-demethylvindoline
  • methyl (2beta,3beta,4beta,5alpha,19alpha)-3,4,16-trihydroxy-1-methyl-6,7-didehydroaspidospermidin-9-ium-3-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:57657

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