Basic information
- CAS
107032-81-5- Standard SMILES
O=C(O)c1cc(=O)c2c(OCC(COc3cccc4oc(C(=O)O)cc(=O)c34)OS(=O)(=O)O)cccc2o1- InChIKey
KOMKRTNQZYEQST-UHFFFAOYSA-N- Molecular formula
- C23H16O14S
- Average molar mass
- 548.4 g/mol
- Monoisotopic mass
- 548.02607635
Names & identifiers
- Preferred name
- Cromolyn sulfate
- IUPAC
- 5-[3-(2-carboxy-4-oxochromen-5-yl)oxy-2-sulfooxypropoxy]-4-oxochromene-2-carboxylic acid
- English name
- 5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-sulfooxy-propoxy]-4-oxo-chrom ene-2-carboxylic acid
- Molecular formula
- C23H16O14S
- Molecular weight
- 0
Names & synonyms
Cromolyn sulfate107032-81-5DTXSID80147881RefChem:128519DTXCID40703725,5'-((2-(Sulfooxy)propane-1,3-diyl)bis(oxy))bis(4-oxo-4H-chromene-2-carboxylic acid)SCHEMBL38616024H-1-Benzopyran-2-carboxylic acid, 5,5'-((2-(sulfooxy)-1,3-propanediyl)bis(oxy))bis(4-oxo-5,5'-{[2-(Sulfooxy)propane-1,3-diyl]bis(oxy)}bis(4-oxo-4H-1-benzopyran-2-carboxylic acid)5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-sulfooxy-propoxy]-4-oxo-chrom ene-2-carboxylic acid
Database identifiers
- CAS
107032-81-5- PubChem CID
- 83897
- DTXSID
DTXSID80147881
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 218 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 1,060
Chemistry & industry
Applications
DescriptionCromolyn sulfate is used to treat the symptoms of mastocytosis. Mastocytosis is a rare condition caused by too many mast cells in the body.
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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