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Moracin C

CAT: 0013-GTR19243440-02Size: 1 gDry Ice: NoHazardous: No
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Description
Moracin C, a natural product, is an anti-inflammatory agent. Moracin C inhibits LPS-activated reactive oxygen species (ROS) and nitric oxide (NO) release from cells.
CAS Number
69120-06-5
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 250 mg/mL (805.57 mM; Ultrasonic)
Smiles
CC (C) =CCc1c (O) cc (cc1O) -c1cc2ccc (O) cc2o1
Molecular Formula
C19H18O4
Molecular Weight
310.34
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Moracin C

Moracin C is a member of benzofurans.

CAS Number69120-06-5
PubChem CID155248
IUPAC Name5-(6-hydroxy-1-benzofuran-2-yl)-2-(3-methylbut-2-enyl)benzene-1,3-diol
Molecular FormulaC19H18O4
Molecular Weight310.3
XLogP4.8
Topological Polar Surface Area73.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity419
SMILES
CC(=CCC1=C(C=C(C=C1O)C2=CC3=C(O2)C=C(C=C3)O)O)C
InChI
InChI=1S/C19H18O4/c1-11(2)3-6-15-16(21)7-13(8-17(15)22)18-9-12-4-5-14(20)10-19(12)23-18/h3-5,7-10,20-22H,6H2,1-2H3
InChIKey
ZTGHWUWBQNCCOH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Moracin C
CAS: 69120-06-5
CID: 155248
Formula: C19H18O4
MW: 310.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight310.3
XLogP34.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass310.12050905
Monoisotopic Mass310.12050905
Topological Polar Surface Area73.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity419
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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