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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

CMP 3 deoxy D glycero beta D galacto nonulosonate(2)  

Type

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

charge

  • -2

formula

  • C18H26N3O16P

inchi

  • InChI=1S/C18H28N3O16P/c19-9-1-2-21(17(31)20-9)15-13(28)12(27)8(35-15)5-34-38(32,33)37-18(16(29)30)3-6(23)10(25)14(36-18)11(26)7(24)4-22/h1-2,6-8,10-15,22-28H,3-5H2,(H,29,30)(H,32,33)(H2,19,20,31)/p-2/t6-,7+,8+,10+,11+,12+,13+,14+,15+,18+/m0/s1

inchikey

  • SFLGTPJBQWRIMH-ZBOJUINDSA-L

mass

  • 571.384

monoisotopicmass

  • 571.10617

smiles

  • C1=CC(=NC(N1[C@@H]2O[C@H](COP(O[C@]3(C[C@H](O)[C@@H](O)[C@@](O3)([C@@H]([C@@H](CO)O)O)[H])C(=O)[O-])(=O)[O-])[C@H]([C@H]2O)O)=O)N

subset

  • 3_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90989

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