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Concept information

Preferred term

cyanomethyl 2,3,4,6-tetra-o-acetyl-alpha-d-mannopyranosyl-(1->6)-2,3,4-tri-o-acetyl-1-thio-alpha-d-mannopyranoside  

Type

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

Broader concept

charge

  • 0

formula

  • C28H37NO17S

inchi

  • InChI=1S/C28H37NO17S/c1-12(30)37-10-19-21(39-13(2)31)23(41-15(4)33)25(43-17(6)35)27(45-19)38-11-20-22(40-14(3)32)24(42-16(5)34)26(44-18(7)36)28(46-20)47-9-8-29/h19-28H,9-11H2,1-7H3/t19-,20-,21-,22-,23+,24+,25+,26+,27+,28-/m1/s1

inchikey

  • VWWRFAIZSWDUNK-HEOQLGAVSA-N

mass

  • 691.657

monoisotopicmass

  • 691.17822

smiles

  • [C@H]1([C@H]([C@H]([C@@H]([C@H](O1)CO[C@@H]2[C@H]([C@H]([C@@H]([C@H](O2)COC(C)=O)OC(C)=O)OC(C)=O)OC(=O)C)OC(C)=O)OC(C)=O)OC(C)=O)SCC#N

subset

  • 3_STAR

synonym EXACT

  • {[2,3,4,6-tetra-O-acetyl-alpha-D-mannopyranosyl-(1->6)-2,3,4-tri-O-acetyl-alpha-D-mannopyranosyl]thio}acetonitrile

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:137953

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