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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate
ChEBI ID CHEBI:62924
ChEBI ASCII Name 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate
Definition A 1D-myo-inositol bis(diphosphate) tetrakisphosphate having the two diphospho groups located at positions 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C6H20O30P8
Net Charge 0
Average Mass 819.986
Monoisotopic Mass 819.79404
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)/t1-,2-,3-,4-,5+,6-/m0/s1
InChIKey HHQOOERQSFJGEP-ZSIQDKGESA-N
SMILES [C@@H]1(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](OP(=O)(O)O)[C@H]1OP(=O)(O)O
ChEBI Ontology
Outgoing 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 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 Sources
(1R,3S,4S,5R,6S)-2,4,5,6-tetrakis(phosphonooxy)cyclohexane-1,3-diyl bis[trihydrogen (diphosphate)] ChEBI
3,5-(PP)2-IP4 SUBMITTER
Manual Xref Database
2YN PDBeChem
View more database links
Citation Waiting for Citations Type Source
25044992 PubMed citation Europe PMC
Last Modified
25 November 2019