1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328)

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CHEBI:133328 - 1D-myo-inositol 1,2,5,6-tetrakisphosphate

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ChEBI ID	CHEBI:133328
ChEBI Name	1D-myo-inositol 1,2,5,6-tetrakisphosphate
Stars
ASCII Name	1D-myo-inositol 1,2,5,6-tetrakisphosphate
Definition	A myo-inositol tetrakisphosphate having the four phosphates placed in the 1-, 2-, 5- and 6-positions.
Last Modified	17 February 2017
Submitter	mwilliams
Downloads	Molfile

Formula	C6H16O18P4
Net Charge	0
Average Mass	500.072
Monoisotopic Mass	499.92871
SMILES	O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1OP(=O)(O)O
InChI	InChI=1S/C6H16O18P4/c7-1-2(8)4(22-26(12,13)14)6(24-28(18,19)20)5(23-27(15,16)17)3(1)21-25(9,10)11/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)/t1-,2-,3-,4+,5-,6-/m1/s1
InChIKey	MRVYFOANPDTYBY-XCMZKKERSA-N

Species of Metabolite	Component	Source	Comments
Glycine max (ncbitaxon:3847)
	-	PubMed (25369450)
	-	MetaboLights (MTBLS118)
	-	MetaboLights (MTBLS117)
Hordeum vulgare (ncbitaxon:4513)	seed (BTO:0001226)	PubMed (24967651)

Roles Classification

Biological Role:

plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology

Outgoing Relation(s)
	1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328) has functional parent myo-inositol (CHEBI:17268)
	1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328) has role plant metabolite (CHEBI:76924)
	1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328) is a myo-inositol tetrakisphosphate (CHEBI:25449)
	1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328) is conjugate acid of 1D-myo-inositol 1,2,5,6-tetrakisphosphate(8−) (CHEBI:195535)
Incoming Relation(s)
Incoming Relation(s)	1D-myo-inositol 1,2,5,6-tetrakisphosphate(8−) (CHEBI:195535) is conjugate base of 1D-myo-inositol 1,2,5,6-tetrakisphosphate (CHEBI:133328)

IUPAC Names
(1R,2R,3R,4S,5R,6R)-5,6-dihydroxycyclohexane-1,2,3,4-tetrayl tetrakis[dihydrogen (phosphate)]
1D-myo-inositol 1,2,5,6-tetrakis(dihydrogen phosphate)

Synonyms	Source
Ins(1,2,5,6)P₄	MetaCyc
D-myo-inositol 1,2,5,6-tetrakisphosphate	ChEBI
D-myo-inositol (1,2,5,6) tetrakisphosphate	MetaCyc

Registry Numbers	Sources
Reaxys:7755312	Reaxys

Citations