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Concept information

Preferred term

tyrocitabine-752  

Type

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

charge

  • 0

formula

  • C32H45N6O13P

inchi

  • InChI=1S/C32H45N6O13P/c1-2-3-4-5-6-7-24(42)48-28-22(47-31(26(28)43)38-17-37-25-29(33)35-16-36-30(25)38)15-46-52(44,45)51-32-23(12-18-8-10-19(40)11-9-18)34-13-21(49-32)27(50-32)20(41)14-39/h8-11,16-17,20-23,26-28,31,34,39-41,43H,2-7,12-15H2,1H3,(H,44,45)(H2,33,35,36)

inchikey

  • NQAVZVIIUVQDRC-UHFFFAOYSA-N

mass

  • 752.715

monoisotopicmass

  • 752.27822

smiles

  • P(=O)(OC12OC(C(O)CO)C(O1)CNC2CC3=CC=C(O)C=C3)(OCC4OC(N5C6=NC=NC(=C6N=C5)N)C(C4OC(=O)CCCCCCC)O)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222572

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