Coriandrin
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Basic information
- CAS
116408-80-1- Standard SMILES
COc1c2ccoc2cc2cc(C)oc(=O)c12- InChIKey
BUZQIMYNOWPYHH-UHFFFAOYSA-N- Molecular formula
- C13H10O4
- Average molar mass
- 230.22 g/mol
- Monoisotopic mass
- 230.0579088
Overview
Coriandrin is a member of isocoumarins.
Names & identifiers
- Preferred name
- Coriandrin
- IUPAC
- 4-methoxy-7-methylfuro[2,3-g]isochromen-5-one
- English name
- coriandrin
- Molecular formula
- C13H10O4
- Molecular weight
- 230.22
Names & synonyms
Coriandrin116408-80-14-methoxy-7-methylfuro[2,3-g]isochromen-5-one4-Methoxy-7-methyl-5H-furo(2,3-g)benzopyran-5-oneDTXSID001513894-METHOXY-7-METHYL-5H-FURO[2,3-G]ISOCHROMEN-5-ONE5H-Furo(2,3-g)(2)benzopyran-5-one, 4-methoxy-7-methyl-4-methoxy-7-methylfuro(2,3-g)isochromen-5-one4-methoxy-7-methyl-5H-furo(2,3-g)isochromen-5-oneRefChem:128029DTXCID90738804-Methoxy-7-methyl-5H-furo[2,3-g][2]benzopyran-5-one
Show more names
5H-Furo[2,3-g][2]benzopyran-5-one, 4-methoxy-7-methyl-
4-Methoxy-7-methyl-5H-Furo(2,3-g)(2)benzopyran-5-oneCCRIS 8086CARIANDRINorb2279312SCHEMBL29405339CHEBI:174178AKOS0407362394-methoxy-7-methyluro[2,3-g]isochromen-5-one
Database identifiers
- CAS
116408-80-1- PubChem CID
- 119586
- DTXSID
DTXSID00151389- ChEBI
CHEBI:174178- Nikkaji
- J451.756C
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 362
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Melting Point142 - 143 °C
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Additional notes
DefinitionChEBI: Coriandrin is a member of isocoumarins.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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