Basic information
- CAS
55165-35-0- Standard SMILES
Cc1cc2c(O)c3c(=O)ccoc3c(OCC(O)C[NH2+]CC(C)C)c2o1.[Cl-]- InChIKey
ILMZTINRCDWCLG-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO6
- Average molar mass
- 397.8 g/mol
- Monoisotopic mass
- 397.1292152
Names & identifiers
- Preferred name
- 4-Hydroxy-9-(2-hydroxy-3-((2-methylpropyl)amino)propoxy)-2-methyl-5H-furo(3,2-g)(1)benzopyran-5-one--hydrogen chloride (1/1)
- IUPAC
- [2-hydroxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropyl]-(2-methylpropyl)azanium chloride
Names & synonyms
DTXSID709705094-Hydroxy-9-(2-hydroxy-3-((2-methylpropyl)amino)propoxy)-2-methyl-5H-furo(3,2-g)(1)benzopyran-5-one--hydrogen chloride (1/1)RefChem:1070802DTXCID00139804055165-35-05H-Furo(3,2-g)(1)benzopyran-5-one, 4-hydroxy-9-(2-hydroxy-3-isobutylaminopropoxy)-7-methyl-, hydrochlorideFuro(3,2-g)chromone, 4-hydroxy-9-(2-hydroxy-3-isobutylaminopropoxy)-7-methyl-,hydrochloride
Database identifiers
- CAS
55165-35-0- PubChem CID
- 41351
Properties
Computed structural properties
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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