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CHEBI:133416 - 1D-myo-inositol 2,4-bisphosphate

Default Structure
ChEBI IDCHEBI:133416
ChEBI Name1D-myo-inositol 2,4-bisphosphate
Stars
ASCII Name1D-myo-inositol 2,4-bisphosphate
DefinitionA myo-inositol bisphosphate in which the two phosphate groups are located at positions 2 and 4.
Last Modified28 February 2017
Submittermwilliams
DownloadsMolfile
FormulaC6H14O12P2
Net Charge0
Average Mass340.114
Monoisotopic Mass339.99605
SMILESO=P(O)(O)O[C@@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C6H14O12P2/c7-1-2(8)5(17-19(11,12)13)4(10)6(3(1)9)18-20(14,15)16/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1-,2-,3+,4-,5-,6-/m0/s1
InChIKeyPUVHMWJJTITUGO-PTQMNWPWSA-N
Species of MetaboliteComponentSourceComments
Glycine max (ncbitaxon:3847)
seed (BTO:0001226) MetaboLights (MTBLS118)
seed (BTO:0001226) MetaboLights (MTBLS117)
seed (BTO:0001226) PubMed (25369450)
ChEBI Ontology
Outgoing Relation(s)
1D-myo-inositol 2,4-bisphosphate (CHEBI:133416) has functional parent myo-inositol (CHEBI:17268)
1D-myo-inositol 2,4-bisphosphate (CHEBI:133416) is a myo-inositol bisphosphate (CHEBI:25443)
IUPAC Names 
(1S,2S,3S,4S,5S,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl bis[dihydrogen (phosphate)]
1D-myo-inositol 2,4-bis(dihydrogen phosphate)
Synonyms  Source
1D-myo-inositol (2,4) bisphosphateMetaCyc
I(2,4)P2MetaCyc
myo-inositol (2,4) bisphosphateMetaCyc
Ins(2,4)P2MetaCyc
Manual XrefsDatabases
CPD-6783MetaCyc
Registry NumbersSources
Reaxys:9433609Reaxys
CAS:27216-57-5ChemIDplus
Citations