MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

sn-glycero-3-phospho-1D-myo-inositol

	Properties	Image
MNX_ID	MNXM1517
reference	chebi:58444
formula	C₉H₁₈O₁₁P
global charge	-1
mol weight	333.206
InChIKey	BMVUIWJCUQSHLZ-UJGXJMNGSA-M
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
SMILES	O=P([O-])(OC[C@H](O)CO)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O

MNX internals

InChI (mnx)	InChI=1/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)/t3-,4-,5-,6+,7-,8-,9-/m1/s1
SMILES (mnx)	[CH2:1]([C@H:3]([CH2:2][O:19][P:21]([OH:17])(=[O:18])[O:20][C@@H:9]1[C@H:7]([OH:15])[C@H:5]([OH:13])[C@@H:4]([OH:12])[C@H:6]([OH:14])[C@H:8]1[OH:16])[OH:11])[OH:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	18
in models (compartimentalized)	11

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-6813734 reactomeM:R-ALL-6813734 CHEBI:58444 chebi:58444 BMVUIWJCUQSHLZ-UJGXJMNGSA-M	sn-glycero-3-phospho-1D-myo-inositol (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 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol 1-(sn-glycero-3-phospho)-1D-myo-inositol(1-) 1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl phosphate] GroPIns
vmhM:M02911 vmhmetabolite:M02911 BMVUIWJCUQSHLZ-UJGXJMNGSA-M	1-(sn-Glycero-3-phospho)-1D-myo-inositol [(2R)-2,3-dihydroxypropoxy]({[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid
CHEBI:18321 chebi:18321 BMVUIWJCUQSHLZ-UJGXJMNGSA-N	1-(sn-glycero-3-phospho)-1D-myo-inositol 1-(sn-glycero-3-Phospho)-1D-myo-inositol 1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl hydrogen phosphate] 3-Phosphoglyceroinositol Glyerophosphoinositol GroPIns sn-glycero-3-Phospho-1-inositol
metacyc.compound:CPD-541 metacycM:CPD-541 BMVUIWJCUQSHLZ-UJGXJMNGSA-M	1-(sn-glycero-3-phospho)-1D-myo-inositol 1-glyceryl-1-myo-Inosityl phosphate GroPIns glycero-phospho-myo-inositol sn-glycero-3-phospho-1-inositol
hmdb:HMDB0011649 BMVUIWJCUQSHLZ-UJGXJMNGSA-N	Glycerophosphoinositol (2R)-2,3-dihydroxypropoxy([(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy)phosphinic acid 1-(sn-Glycero-3-phospho)-1D-myo-inositol 3-Phosphoglyceroinositol Glyerophosphoinositol GroPIns [(2R)-2,3-dihydroxypropoxy]({[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid alpha-Glycerophosphoryl inositol alpha-Glycerophosphorylinositol sn-Glycero-3-phospho-1-inositol
bigg.metabolite:g3pi biggM:g3pi BMVUIWJCUQSHLZ-UHFFFAOYSA-M	Sn-Glycero-3-phospho-1-inositol
kegg.compound:C01225 keggC:C01225 BMVUIWJCUQSHLZ-UJGXJMNGSA-N	sn-Glycero-3-phospho-1-inositol 1-(sn-Glycero-3-phospho)-1D-myo-inositol
sabiork.compound:5457 sabiorkM:5457 BMVUIWJCUQSHLZ-UJGXJMNGSA-N	sn-Glycero-3-phospho-1-inositol 1-(sn-glycero-3-Phospho)-1D-myo-inositol
seed.compound:cpd00902 seedM:cpd00902 BMVUIWJCUQSHLZ-UJGXJMNGSA-M	sn-glycero-3-Phospho-1-inositol 1-(sn-Glycero-3-phospho)-1D-myo-inositol 1-(sn-glycero-3-Phospho)-1D-myo-inositol 1-(sn-glycero-3-phospho)-1D-myo-inositol g3pi sn-Glycero-3-phospho-1-inositol sn-glycero-3-phospho-1-inositol
hmdb:HMDB11649 chebi:10645 chebi:11200 chebi:26695 chebi:64715 biggM:M_g3pi keggC:M_C01225 seedM:M_cpd00902 vmhM:M_M02911	secondary/obsolete/fantasy identifier