Basic information
- CAS
141816-32-2- Standard SMILES
CC1(CO)OP(=O)(O)OP(=O)(O)OCC1O- InChIKey
SFRQRNJMIIUYDI-UHFFFAOYSA-N- Molecular formula
- C5H12O9P2
- Average molar mass
- 278.09 g/mol
- Monoisotopic mass
- 277.99565595
Overview
2-C-methyl-D-erythritol-2,4-cyclopyrophosphate has been reported in Escherichia coli with data available.
Names & identifiers
- Preferred name
- 2-Methyl-butan-1,2,3,4-tetraol-2,4-cyclopyrophosphate
- IUPAC
- 2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2λ5,4λ5-trioxadiphosphocan-7-ol
- English name
- 2-methyl-butan-1,2,3,4-tetraol-2,4-cyclopyrophosphate
- Molecular formula
- C5H12O9P2
- Molecular weight
- 278.09
Names & synonyms
Mbtcpp141816-32-22-C-Methyl-D-erythritol-2,4-cyclopyrophosphate2-Methyl-butan-1,2,3,4-tetraol-2,4-cyclopyrophosphate2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-olRefChem:882296-(hydroxymethyl)-6-methyl-1,3,5,2,4-trioxadiphosphocane-2,4,7-triol 2,4-dioxideSCHEMBL29634893DTXSID10931210151435-51-72,4,7-Trihydroxy-6-methyl-1,3,5,2,4-trioxadiphosphene-6-methanol 2,4-dioxidePD040318
Show more names
1,3,5,2,4-Trioxadiphosphocane-6-methanol, 2,4,7-trihydroxy-6-methyl-, 2,4-dioxide
Q28138092-C-Methyl-D-erythritol 1,2-cyclophosphate 4-phosphate1,3,5,2,4-Trioxadiphosphene-6-methanol, 2,4,7-trihydroxy-6-methyl-, 2,4-dioxide2,4,7-Trihydroxy-6-(hydroxymethyl)-6-methyl-1,3,5,2lambda~5~,4lambda~5~-trioxadiphosphocane-2,4-dione
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- -2.8
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 356
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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