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CHEBI:62924 - 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate

ChEBI IDCHEBI:62924
ChEBI Name3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate
Stars
ASCII Name3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate
DefinitionA 1D-myo-inositol bis(diphosphate) tetrakisphosphate having the two diphospho groups located at positions 3 and 5.
Last Modified25 November 2019
Submittermwilliams
DownloadsMolfile
FormulaC6H20O30P8
Net Charge0
Average Mass819.988
Monoisotopic Mass819.79403
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](OP(=O)(O)O)[C@H](OP(=O)(O)OP(=O)(O)O)[C@H]1OP(=O)(O)O
InChIInChI=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)/t1-,2-,3-,4-,5+,6-/m0/s1
InChIKeyHHQOOERQSFJGEP-ZSIQDKGESA-N
ChEBI Ontology
Outgoing Relation(s)
3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate (CHEBI:62924) has functional parent myo-inositol (CHEBI:17268)
3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate (CHEBI:62924) is a 1D-myo-inositol bis(diphosphate) tetrakisphosphate (CHEBI:14178)
3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate (CHEBI:62924) is conjugate acid of 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate(13−) (CHEBI:140372)
Incoming Relation(s)
3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate(13−) (CHEBI:140372) is conjugate base of 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate (CHEBI:62924)
IUPAC Name 
1,2,4,6-tetrakis-O-phosphono-1D-myo-inositol 3,5-bis[trihydrogen (diphosphate)]
Synonyms  Source
3,5-(PP)2-IP4SUBMITTER
(1R,3S,4S,5R,6S)-2,4,5,6-tetrakis(phosphonooxy)cyclohexane-1,3-diyl bis[trihydrogen (diphosphate)]ChEBI
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