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CHEBI:62926 - 1-diphospho-1D-myo-inositol 3,4,5,6-tetrakisphosphate

ChEBI IDCHEBI:62926
ChEBI Name1-diphospho-1D-myo-inositol 3,4,5,6-tetrakisphosphate
Stars
ASCII Name1-diphospho-1D-myo-inositol 3,4,5,6-tetrakisphosphate
DefinitionA myo-inositol tetrakisphosphate that consists of myo-inositol having the four phospho groups located at positions 3, 4, 5 and 6 as well as a diphospho group at position 1.
Last Modified18 October 2011
Submittermwilliams
DownloadsMolfile
FormulaC6H18O24P6
Net Charge0
Average Mass660.030
Monoisotopic Mass659.86137
SMILESO=P(O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O
InChIInChI=1S/C6H18O24P6/c7-1-2(25-31(8,9)10)4(26-32(11,12)13)6(28-34(17,18)19)5(27-33(14,15)16)3(1)29-36(23,24)30-35(20,21)22/h1-7H,(H,23,24)(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2+,3-,4-,5+,6+/m1/s1
InChIKeyRLQGQDJUKRAXDX-YORTWTKJSA-N
ChEBI Ontology
Outgoing Relation(s)
1-diphospho-1D-myo-inositol 3,4,5,6-tetrakisphosphate (CHEBI:62926) has functional parent myo-inositol (CHEBI:17268)
1-diphospho-1D-myo-inositol 3,4,5,6-tetrakisphosphate (CHEBI:62926) is a myo-inositol tetrakisphosphate (CHEBI:25449)
IUPAC Name 
3,4,5,6-tetrakis-O-phosphono-1D-myo-inositol 1-(trihydrogen diphosphate)
Synonyms  Source
1-PP-IP4SUBMITTER
(1R,2R,3S,4R,5S,6S)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl trihydrogen diphosphateIUPAC