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Concept information

Preferred term

سیستوسین  

Type

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

charge

  • 0

formula

  • C16H25N7O4S

inchi

  • InChI=1S/C16H25N7O4S/c1-22(2)13-11-14(19-6-18-13)23(7-20-11)16-12(25)10(9(4-24)27-16)21-15(26)8(17)5-28-3/h6-10,12,16,24-25H,4-5,17H2,1-3H3,(H,21,26)/t8-,9?,10+,12+,16?/m0/s1

inchikey

  • INAIUCSAMKOUMV-MYIMGPFRSA-N

mass

  • 411.480

monoisotopicmass

  • 411.16887

smiles

  • S(C[C@H](N)C(=O)N[C@H]1[C@@H](O)C(N2C3=NC=NC(=C3N=C2)N(C)C)OC1CO)C

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-amino-N-[(3S,4R)-5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-methylsulanylpropanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227444

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