Basic information
- CAS
60802-29-1- Standard SMILES
O=C(CO)C(O)C(O)COP(=O)(O)O- InChIKey
FNZLKVNUWIIPSJ-UHFFFAOYSA-N- Molecular formula
- C5H11O8P
- Average molar mass
- 230.11 g/mol
- Monoisotopic mass
- 230.0191543
Overview
Xylulose 5-phosphate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Names & identifiers
- Preferred name
- Pentulose, 5-phosphate
- IUPAC
- (2,3,5-trihydroxy-4-oxopentyl) dihydrogen phosphate
- English name
- xylulose-5-phosphate
- Molecular formula
- C5H11O8P
- Molecular weight
- 230.11
Names & synonyms
xylulose-5-phosphate(2,3,5-trihydroxy-4-oxopentyl) dihydrogen phosphateDTXSID601314181Pentulose, 5-phosphate60802-29-1RefChem:171505DTXCID30811964[(2,3,5-trihydroxy-4-oxopentyl)oxy]phosphonic acid(2,3,5-TRIHYDROXY-4-OXO-PENTOXY)PHOSPHONIC ACID5-o-phosphonopent-2-uloseMFCD3455034693-87-8(free acid)
Show more names
2-Pentulose 5-(dihydrogen phosphate)
SCHEMBL16163640AAA09387MFCD34550349D-RIBULOSE 5-PHOSPHATE SODIUM2-Pentulose, 5-(dihydrogen phosphate)SY286900SY286903F43E39B7-2B6E-4B4E-BBA9-8F612AAFACC2
Database identifiers
- CAS
60802-29-1- PubChem CID
- 850
- DTXSID
DTXSID601314181
Properties
Computed structural properties
- XLogP
- -3.7
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Boiling point
- 620.3 · 620.3±65.0 °C(Predicted)
- Density
- 1.812 · 1.812±0.06 g/cm3(Predicted)
- pka
- 1.82 · 1.82±0.10(Predicted)
Chemistry & industry
Suppliers3 total
陕西星贝爱科生物科技有限责任公司029-13572876172 13572876172 · [email protected]
北京倍特仁康生物医药科技有限公司15810027898 18600213301 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Additional notes
DefinitionChEBI: D-xylulose 5-phosphate is the D-enantiomer of xylulose 5-phosphate. It has a role as an Escherichia coli metabolite and a mouse metabolite. It is functionally related to a D-xylulose. It is a conjugate acid of a D-xylulose 5-phosphate(2-). It is an enantiomer of a L-xylulose 5-phosphate.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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