D-xylose 5-phosphate
Basic information
- CAS
66768-39-6- Standard SMILES
O=C[C@H](O)[C@@H](O)[C@H](O)COP(=O)(O)O- InChIKey
PPQRONHOSHZGFQ-VPENINKCSA-N- Molecular formula
- C5H11O8P
- Average molar mass
- 230.11 g/mol
- Monoisotopic mass
- 230.0191543
Overview
D-xylose 5-phosphate is a xylose phosphate that is D-xylose carrying a phosphate group at position 5. It has a role as a bacterial metabolite. It is functionally related to an aldehydo-D-xylose.
Names & identifiers
- Preferred name
- D-xylose 5-phosphate
- IUPAC
- [(2R,3S,4R)-2,3,4-trihydroxy-5-oxopentyl] dihydrogen phosphate
Names & synonyms
D-xylose 5-phosphateD-Xylose-5-phosphate5-O-phosphono-D-xyloseD-xylose 5-(dihydrogen phosphate)CHEBI:37492RefChem:130689GlyTouCan:G91451JYG91451JY66768-39-6[(2R,3S,4R)-2,3,4-trihydroxy-5-oxopentyl] dihydrogen phosphatexylose-5-phosphateSCHEMBL850111
Show more names
DTXSID501377338(2R,3S,4R)-2,3,4-Trihydroxy-5-oxopentyl dihydrogen phosphateD-Xylose, 5-(dihydrogen phosphate)C06814Q27104409
Database identifiers
- CAS
66768-39-6- PubChem CID
- 441187
- DTXSID
DTXSID501377338- ChEBI
CHEBI:37492- Nikkaji
- J2.764.070B
Properties
Computed structural properties
- XLogP
- -3.4
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Experimental & physicochemical properties
Collision Cross Section
139.3 Ų [M-H]- [CCS Type: DT; Method: stepped-field]
138.9 Ų [M-H]-
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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