RefMet Compound Details

RefMet ID	RM0155901
MW structure	50236 (View MW Metabolite Database details)
RefMet name	Sedoheptulose 7-phosphate
Systematic name	D-altro-hept-2-ulose 7-phosphate
SMILES	C(C(=O)[C@H]([C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass	290.040288 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C7H15O10P	View other entries in RefMet with this formula
InChI	InChI=1S/C7H15O10P/c8-1-3(9)5(11)7(13)6(12)4(10)2-17-18(14,15)16/h4-8,10-13H,1-2H2,(H2,14,15,16)/t4-,5-,6-,7+/m1/s1
InChIKey	JDTUMPKOJBQPKX-GBNDHIKLSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
Super Class	Carbohydrates
Main Class	Monosaccharides
Sub Class	Monosaccharide phosphates
Pubchem CID	165007
ChEBI ID	15721
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Sedoheptulose 7-phosphate

Rxn ID	KEGG Reaction	Enzyme
R01641	Sedoheptulose 7-phosphate + D-Glyceraldehyde 3-phosphate <=> D-Ribose 5-phosphate + D-Xylulose 5-phosphate	sedoheptulose-7-phosphate:D-glyceraldehyde-3-phosphate glycolaldehyde transferase
R01827	Sedoheptulose 7-phosphate + D-Glyceraldehyde 3-phosphate <=> D-Erythrose 4-phosphate + beta-D-Fructose 6-phosphate	sedoheptulose-7-phosphate:D-glyceraldehyde-3-phosphate glyceronetransferase
R01844	ATP + Sedoheptulose <=> ADP + Sedoheptulose 7-phosphate	ATP:sedoheptulose 7-phosphate

Table of KEGG human pathways containing Sedoheptulose 7-phosphate

Pathway ID	Human Pathway	# of reactions
hsa00030	Pentose phosphate pathway	2
hsa01200	Carbon metabolism	2
hsa01230	Biosynthesis of amino acids	2
hsa01100	Metabolic pathways	1