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Concept information

Preferred term

1,5-bis(diphospho)-1d-myo-inositol 2,3,4,6-tetrakisphosphate(13-)  

Type

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

charge

  • -13

formula

  • C6H7O30P8

inchi

  • InChI=1S/C6H20O30P8/c7-37(8,9)29-1-2(30-38(10,11)12)5(33-43(25,26)35-41(19,20)21)4(32-40(16,17)18)6(3(1)31-39(13,14)15)34-44(27,28)36-42(22,23)24/h1-6H,(H,25,26)(H,27,28)(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)/p-13/t1-,2-,3-,4-,5+,6-/m1/s1

inchikey

  • HHQOOERQSFJGEP-SLWYWOEDSA-A

mass

  • 806.89900

monoisotopicmass

  • 806.69944

smiles

  • OP([O-])(=O)OP([O-])(=O)O[C@@H]1[C@H](OP([O-])([O-])=O)[C@H](OP([O-])([O-])=O)[C@@H](OP([O-])([O-])=O)[C@H](OP([O-])(=O)OP([O-])([O-])=O)[C@H]1OP([O-])([O-])=O

subset

  • 3_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:77983

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