Basic information
- CAS
135248-05-4- Standard SMILES
CC(C)=CCc1cc2cc(-c3cc(O)cc(O)c3)oc2cc1O- InChIKey
WBSCSIABHGPAMC-UHFFFAOYSA-N- Molecular formula
- C19H18O4
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.12050906
Overview
Moracin N is a member of benzofurans.
Names & identifiers
- Preferred name
- Moracin N
- IUPAC
- 5-[6-hydroxy-5-(3-methylbut-2-enyl)-1-benzofuran-2-yl]benzene-1,3-diol
- English name
- 1,3-Benzenediol, 5-[6-hydroxy-5-(3-methyl-2-buten-1-yl)-2-benzofuranyl]-
- Molecular formula
- C19H18O4
- Molecular weight
- 310.34
Names & synonyms
moracin N135248-05-4DTXSID5013187045-[6-hydroxy-5-(3-methylbut-2-enyl)-1-benzofuran-2-yl]benzene-1,3-diol5-[6-hydroxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol5-(6-hydroxy-5-(3-methylbut-2-enyl)-1-benzofuran-2-yl)benzene-1,3-diol5-(6-hydroxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl)benzene-1,3-diolRefChem:926122DTXCID201748504CHEMBL4658811,3-Benzenediol, 5-[6-hydroxy-5-(3-methyl-2-buten-1-yl)-2-benzofuranyl]-orb2277540
Show more names
5-(6-Hydroxy-5-(3-methylbut-2-en-1-yl)benzofuran-2-yl)benzene-1,3-diol
SCHEMBL6822289CHEBI:174237WBSCSIABHGPAMC-UHFFFAOYSA-NBDBM50251014HY-N118491,3-benzenediol, 5-[6-hydroxy-5-(3-methyl-2-butenyl)-2-benzofuranyl]-DA-75680CS-0880943
Database identifiers
- CAS
135248-05-4- PubChem CID
- 641376
- DTXSID
DTXSID501318704- ChEMBL
CHEMBL465881- ChEBI
CHEBI:174237- Nikkaji
- J408.843C
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 421
Experimental & physicochemical properties
Melting Point187 - 188 °C
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 430.6 · 430.6±40.0 °C(Predicted)
- Density
- 1.278 · 1.278±0.06 g/cm3(Predicted)
- form
- Solid
- pka
- 9.08 · 9.08±0.10(Predicted)
- color
- White to off-white
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Applications
UsesMoracin N is a ferroptosis inhibitor that can be isolated from mulberry leaf. Moracin N exerts neuroprotective activity through preventing from oxidative stress[1].
Suppliers4 total
云南西力生物技术股份有限公司0871-65217109 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
广州优南科技有限公司020-82000279 18988941452 · [email protected]
Additional notes
DefinitionChEBI: Moracin N is a member of benzofurans.
Related reactions
2 records
Compound notes
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