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Concept information

Preferred term

decarbamoylgonyautoxin-4  

Type

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

charge

  • 0

formula

  • C9H16N6O8S

inchi

  • InChI=1S/C9H16N6O8S/c10-6-12-5-3(2-16)15(19)7(11)14-1-4(23-24(20,21)22)9(17,18)8(5,14)13-6/h3-5,11,16-19H,1-2H2,(H3,10,12,13)(H,20,21,22)/t3-,4-,5-,8-/m0/s1

inchikey

  • AXKNFGCPJPRVCA-RGDLXGNYSA-N

mass

  • 368.320

monoisotopicmass

  • 368.07503

smiles

  • S(=O)(=O)(O[C@@H]1C(O)(O)[C@]23NC(N)=N[C@H]2[C@H](CO)N(C(N3C1)=N)O)O

subset

  • 2_STAR

synonym EXACT

  • [(3aS,4R,9S,10aS)-2-amino-5,10,10-trihydroxy-4-(hydroxymethyl)-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] hydrogen sulate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214672

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