Basic information
- CAS
61871-71-4- Standard SMILES
CCCCCC(=O)CC(=O)CCc1ccc(O)c(OC)c1- InChIKey
KMNVXQHNIWUUSE-UHFFFAOYSA-N- Molecular formula
- C17H24O4
- Average molar mass
- 292.4 g/mol
- Monoisotopic mass
- 292.16745925
Overview
[6]-Gingerdione is a monomethoxybenzene, a member of phenols and a beta-diketone.
Names & identifiers
- Preferred name
- Gingerdione
- IUPAC
- 1-(4-hydroxy-3-methoxyphenyl)decane-3,5-dione
- English name
- gingerdione
- Molecular formula
- C17H24O4
- Molecular weight
- 292.37
Names & synonyms
Gingerdione61871-71-4[6]-GingerdioneL2L6JCL6YY3,5-Decanedione, 1-(4-hydroxy-3-methoxyphenyl)-(6)-GingerdioneDTXSID50210854RefChem:143201DTXCID801333451-(4-hydroxy-3-methoxyphenyl)decane-3,5-dione6-Gingerdione1-(4-Hydroxy-3-methoxyphenyl)-3,5-decanedione
Show more names
UNII-L2L6JCL6YY6-hydrogingerdioneorb2663508CHEMBL2071439SCHEMBL13469402SCHEMBL29483336CHEBI:10135KMNVXQHNIWUUSE-UHFFFAOYSA-N
Database identifiers
- CAS
61871-71-4- PubChem CID
- 162952
- DTXSID
DTXSID50210854- ChEMBL
CHEMBL2071439- ChEBI
CHEBI:10135- UNII
- L2L6JCL6YY
- Nikkaji
- J470.464I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 327
Physicochemical properties
- LogP
- 3.537 · 3.537 (est)
- FDA UNII
- 2 L6JCL6YY · L2L6JCL6YY
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Applications
Uses[6]-Gingerdione is a prostaglandin synthesis inhibitor that can be isolated from ginger rhizomes.
Suppliers6 total
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
南京新瑞医药科技有限公司19850079587 · [email protected]
BOC Sciences16314854226 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Additional notes
DefinitionChEBI: [6]-Gingerdione is a member of phenols, a beta-diketone and a monomethoxybenzene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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