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Cnidicin (Standard)

CAT: 0804-HY-N4207RSize: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-N4207RSize:1 Each
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Description
Cnidicin (Standard) is the analytical standard of Cnidicin. This product is intended for research and analytical applications. Cnidicin, a coumarin, inhibits the degranulation of mast cell and the nitric oxide (NO) generation in RAW 264.7 cells[1].
CAS Number
14348-21-1
UNSPSC
12352005
Target
Others; Reference Standards
Type
Reference Standards
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/cnidicin-standard.html
Smiles
O=C1C=CC2=C(OC/C=C(C)/C)C3=C(OC=C3)C(OC/C=C(C)/C)=C2O1
Molecular Formula
C21H22O5
Molecular Weight
354.40
References & Citations
[1]Ryu SY, et al. Cnidicin, a coumarin, from the root of Angelica koreana, inhibits the degranulation of mast cell and the NO generation in RAW 264.7 cells. Planta Med. 2001 Mar;67 (2) :172-4.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

4,9-Bis[(3-methylbut-2-en-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one

Cnidicin has been reported in Ostericum grosseserratum with data available.

CAS Number14348-21-1
PubChem CID10043694
IUPAC Name4,9-bis(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one
Molecular FormulaC21H22O5
Molecular Weight354.4
XLogP5.3
Topological Polar Surface Area57.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity598
SMILES
CC(=CCOC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OCC=C(C)C)C
InChI
InChI=1S/C21H22O5/c1-13(2)7-10-23-18-15-5-6-17(22)26-20(15)21(25-11-8-14(3)4)19-16(18)9-12-24-19/h5-9,12H,10-11H2,1-4H3
InChIKey
HJMDOAWWVCOEDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,9-Bis[(3-methylbut-2-en-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one
CAS: 14348-21-1
CID: 10043694
Formula: C21H22O5
MW: 354.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.4
XLogP35.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass354.14672380
Monoisotopic Mass354.14672380
Topological Polar Surface Area57.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity598
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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