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Concept information

Preferred term

decarbamoylgonyautoxin iii  

Type

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

charge

  • 0

formula

  • C9H16N6O7S

inchi

  • InChI=1S/C9H16N6O7S/c10-6-13-5-3(2-16)12-7(11)15-1-4(22-23(19,20)21)9(17,18)8(5,15)14-6/h3-5,16-18H,1-2H2,(H2,11,12)(H3,10,13,14)(H,19,20,21)

inchikey

  • AJLCXXKDNUGKKH-UHFFFAOYSA-N

mass

  • 352.320

monoisotopicmass

  • 352.08012

smiles

  • S(OC1C(O)(O)C23N(C1)C(=NC(C3N=C(N2)N)CO)N)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • [2,6-diamino-10,10-dihydroxy-4-(hydroxymethyl)-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] hydrogen sulate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:166661

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