CHEBI:58444 - 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol

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ChEBI Name 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol
ChEBI ID CHEBI:58444
ChEBI ASCII Name 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol
Definition An inositol phosphate oxoanion obtained by deprotonation of the free phosphate OH group of 1-(sn-glycero-3-phospho)-1D-myo-inositol; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Alan Bridge
Secondary ChEBI IDs CHEBI:64715
Supplier Information
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Formula C9H18O11P
Net Charge -1
Average Mass 333.20640
Monoisotopic Mass 333.059
InChI InChI=1S/C9H19O11P/c10-1-3(11)2-19-21(17,18)20-9-7(15)5(13)4(12)6(14)8(9)16/h3-16H,1-2H2,(H,17,18)/p-1/t3-,4-,5-,6+,7-,8-,9-/m1/s1
InChIKey BMVUIWJCUQSHLZ-UJGXJMNGSA-M
SMILES OC[C@@H](O)COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (CHEBI:58444) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (CHEBI:58444) is a inositol phosphate oxoanion (CHEBI:76301)
1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (CHEBI:58444) is conjugate base of 1-(sn-glycero-3-phospho)-1D-myo-inositol (CHEBI:18321)
Incoming 1-(sn-glycero-3-phospho)-1D-myo-inositol (CHEBI:18321) is conjugate acid of 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (CHEBI:58444)
IUPAC Names
(2R)-2,3-dihydroxypropyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate
(2S)-2,3-dihydroxypropyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate
1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl phosphate]
Synonyms Sources
1-(sn-glycero-3-phospho)-1D-myo-inositol(1−) ChEBI
GroPIns SUBMITTER
sn-glycero-3-phospho-1D-myo-inositol UniProt
Manual Xref Database
CPD-541 MetaCyc
View more database links
Last Modified
21 January 2016