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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > ion > cation > organic cation > iminium ion > saxitoxin(2+)

Preferred term

saxitoxin(2+)  

Type

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

Broader concept

charge

  • +2

formula

  • C10H19N7O4

inchi

  • InChI=1S/C10H17N7O4/c11-6-15-5-4(3-21-8(13)18)14-7(12)17-2-1-9(19,20)10(5,17)16-6/h4-5,19-20H,1-3H2,(H2,12,14)(H2,13,18)(H3,11,15,16)/p+2/t4-,5-,10-/m0/s1

inchikey

  • RPQXVSUAYFXFJA-HGRQIUPRSA-P

is_conjugate_acid_of

mass

  • 301.306

monoisotopicmass

  • 301.14875

smiles

  • [H][C@@]12NC(=[NH2+])N[C@]11N(CCC1(O)O)C(=[NH2+])N[C@H]2COC(N)=O

subset

  • 3_STAR

synonym EXACT

  • (3aS,4R,10aS)-4-[(carbamoyloxy)methyl]-10,10-dihydroxyhexahydro-1H,8H-pyrrolo[1,2-c]purine-2,6-bis(iminium)

synonym RELATED

  • saxitoxin
  • saxitoxin dication

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:180458

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