Basic information
- Standard SMILES
O=C(CO)C(O)C(O)CO- InChIKey
ZAQJHHRNXZUBTE-UHFFFAOYSA-N- Molecular formula
- C5H10O5
- Average molar mass
- 150.13 g/mol
- Monoisotopic mass
- 150.05282342
Overview
D-Xylulose is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Names & identifiers
- Preferred name
- Ribulose
- IUPAC
- 1,3,4,5-tetrahydroxypentan-2-one
- English name
- 2-Pentulose(9CI)
- Molecular formula
- C5H10O5
- Molecular weight
- 150.13
Names & synonyms
RIBULOSE, DL-DTXSID30204115RefChem:930757CHEBI:28721DTXCID301266065556-48-9ArabinuloseAraboketoseDJM6K5T6YAerythro-2-PentuloseRibuloseD-[1-13C]threo-pent-2-ulose
Show more names
2-Pentulose(9CI)
Threo-2-pentulose (9CI)7558-89-61,3,4,5-tetrahydroxypentan-2-one2-pentuloserel-XyluloseD-[1-13C]ERYTHRO-PENT-2-ULOSED-[2-13C]ERYTHRO-PENT-2-ULOSEpentulose
Database identifiers
- CAS
7558-89-6- PubChem CID
- 619
- DTXSID
DTXSID50862019- ChEMBL
CHEMBL281818- Nikkaji
- J1.544.970E
Properties
Computed structural properties
- XLogP
- -2.6
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 113
Experimental & physicochemical properties
Collision Cross Section132 Ų [M+Na]+
Physicochemical properties
- Boiling point
- 469.1 · 469.1±45.0 °C(Predicted)
- Density
- 1.516 · 1.516±0.06 g/cm3(Predicted)
- pka
- 11.9 · 11.90±0.20(Predicted)
Chemistry & industry
Suppliers1 total
南京艾比克斯生化科技有限公司025-87193546 18652950785 · [email protected]
Related reactions
2 records
Linked notes
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