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Dehydrocostuslactone

CAT: 0931-TN6718-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN6718-01Size:1 mg
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CAS Number
74299-48-2
Target
Others, Antifungal
Related Pathways
Microbiology/Virology, Others
Purity
0.998
Bioactivity
Dehydrocostuslactone is a natural product extracted from Aucklandia.It has wide spectrum of biological effects, including anti-inflammatory, anticancer, antiviral, antimicrobial, antifungal, antioxidant, antidiabetic, antiulcer, and anthelmintic activities.
Smiles
C=C1C2C3C(C(=C)C(=O)O3)CCC(=C)C2CC1
Molecular Formula
C15H18O2
Molecular Weight
230.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one

3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one is a sesquiterpene lactone.

CAS Number74299-48-2
PubChem CID4426320
IUPAC Name3,6,9-trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one
Molecular FormulaC15H18O2
Molecular Weight230.30
XLogP2.6
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count17
Formal Charge0
Complexity432
SMILES
C=C1CCC2C(C3C1CCC3=C)OC(=O)C2=C
InChI
InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h11-14H,1-7H2
InChIKey
NETSQGRTUNRXEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-2-one
CAS: 74299-48-2
CID: 4426320
Formula: C15H18O2
MW: 230.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.30
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass230.130679813
Monoisotopic Mass230.130679813
Topological Polar Surface Area26.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5765316Dehydrocostuslactone

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