Basic information
- CAS
14787-38-3- Standard SMILES
Cc1cc(O)c2c(c1)C(=O)C=CC2=O- InChIKey
OZUSCVSONBBWOR-UHFFFAOYSA-N- Molecular formula
- C11H8O3
- Average molar mass
- 188.18 g/mol
- Monoisotopic mass
- 188.04734411
Overview
Ramentaceone is a hydroxy-1,4-naphthoquinone.
Names & identifiers
- Preferred name
- Ramentaceone
- IUPAC
- 5-hydroxy-7-methylnaphthalene-1,4-dione
- English name
- 7-METHYL-JUGLONE
- Molecular formula
- C11H8O3
- Molecular weight
- 188.18
Names & synonyms
Ramentaceone7-Methyljuglone14787-38-35-hydroxy-7-methylnaphthalene-1,4-dione7-MethyljuglonJUGLONE, 7-METHYL-5-Hydroxy-7-methyl-1,4-naphthoquinone5-Hydroxy-7-methyl-1,4-naphthalenedione1,4-Naphthalenedione, 5-hydroxy-7-methyl-ZS3RW9P6DY1,4-NAPHTHOQUINONE, 5-HYDROXY-7-METHYL-NSC-208733
Show more names
Nsc624625Aids108047NSC 208733Aids-1080476-Methyl-8-hydroxy-1,4-naphthoquinone
NSC-6246254-08-00-02374 (Beilstein Handbook Reference)5-hydroxy-7-methyl-naphthalene-1,4-dioneDTXSID80163824RefChem:930550DTXCID80863157-METHYL-JUGLONENSC208733
Database identifiers
- CAS
14787-38-3- PubChem CID
- 26905
- DTXSID
DTXSID80163824- ChEMBL
CHEMBL430853- ChEBI
CHEBI:8773- UNII
- ZS3RW9P6DY
- Nikkaji
- J8.522G
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 306
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 125.5 · 125.5-126.5 °C
- Boiling point
- 427.2 · 427.2±45.0 °C(Predicted)
- Density
- 1.44 g/cm3 · 1.44 g/cm3
- storage temp.
- 2 · 2-8°C
- pka
- 6.66 · 6.66±0.20(Predicted)
- FDA UNII
- 3 RW9P6DY · ZS3RW9P6DY
Chemistry & industry
Applications
UsesRamentaceone (7-Methyljuglon), a naphthoquinone that can be isolated from Drosera sp., inhibits PI3K activity. Ramentaceone (7-Methyljuglon) reduces the expression of the PI3K protein and inhibits the phosphorylation of the Akt protein in breast cancer cells. Ramentaceone (7-Methyljuglon) induces apoptosis[1].
Upstream & downstream products
Downstream products
Suppliers11 total
吉林中科研伸科技有限公司18143011203 · [email protected]
苏州岚云医药科技有限公司2332782371 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海指月生物科技有限公司13918644899 · [email protected]
贵州谦一科技有限责任公司16651422671 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
上海索本生物科技有限公司13023173052 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Additional notes
DefinitionChEBI: Ramentaceone is a hydroxy-1,4-naphthoquinone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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