Basic information
- CAS
68421-13-6- Standard SMILES
COc1c2c(c(OC)c3oc(=O)ccc13)OC(C)(C)C=C2- InChIKey
QZUNAFWZEXJWGD-UHFFFAOYSA-N- Molecular formula
- C16H16O5
- Average molar mass
- 288.29 g/mol
- Monoisotopic mass
- 288.09977361
Overview
Racemosin is a member of coumarins.
Names & identifiers
- Preferred name
- Racemosin
- IUPAC
- 5,10-dimethoxy-2,2-dimethylpyrano[3,2-g]chromen-8-one
- English name
- 5,10-Dimethoxy-8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one
- Molecular formula
- C16H16O5
- Molecular weight
- 288.3
Names & synonyms
Racemosin68421-13-6K8B360AVZG2H,8H-Benzo(1,2-b:5,4-b')dipyran-2-one, 5,10-dimethoxy-8,8-dimethyl-DTXSID50218537RefChem:1097953DTXCID00141028Ceylantin5,10-dimethoxy-2,2-dimethylpyrano[3,2-g]chromen-8-oneCHEMBL23343505,10-Dimethoxy-8,8-dimethyl-2H,8H-benzo[1,2-bUNII-K8B360AVZG
Show more names
5,10-Dimethoxy-8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one2H,8H-Benzo[1,2-b:5,4-b']dipyran-2-one, 5,10-dimethoxy-8,8-dimethyl-
orb2279486SCHEMBL29456071SCHEMBL41984209CHEBI:182214BDBM50428421AKOS040734528NS00097412T124406
Database identifiers
- CAS
68421-13-6- PubChem CID
- 155148
- DTXSID
DTXSID50218537- ChEMBL
CHEMBL2334350- ChEBI
CHEBI:182214- UNII
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 481
Physicochemical properties
- FDA UNII
- 8 B360AVZG · K8B360AVZG
Chemistry & industry
Suppliers1 total
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: Racemosin is a member of coumarins.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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