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Epoxymicheliolide

CAT: 0804-HY-N0845-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N0845-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Epoxymicheliolide is a micheliolide derivative.
CAS Number
1343403-10-0
Product Name Alternative
1β,10β-Epoxymicheliolide
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Applications
COVID-19-immunoregulation
Field of Research
Inflammation/Immunology
Assay Protocol
https://www.medchemexpress.com/Epoxymicheliolide.html
Purity
99.84
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
C[C@]1(CC[C@](C2=C)([H])[C@@](OC2=O)([H])[C@@]3([H])[C@](C)(O)CC4)[C@]34O1
Molecular Formula
C15H20O4
Molecular Weight
264.32
References & Citations
[1]Qi Z, et al. Study of effects of micheliolide on ovarian cancer cell lines and its mechanism. Zhonghua Fu Chan Ke Za Zhi. 2016 Sep 25;51 (9) :688-692
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture and light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Epoxymicheliolide
CAS Number1343403-10-0
PubChem CID71490387
IUPAC Name(1R,3S,6S,10S,11S,12R)-12-hydroxy-3,12-dimethyl-7-methylidene-2,9-dioxatetracyclo[9.3.0.01,3.06,10]tetradecan-8-one
Molecular FormulaC15H20O4
Molecular Weight264.32
XLogP1.2
Topological Polar Surface Area59.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity500
SMILES
C[C@]1(CC[C@@]23[C@H]1[C@@H]4[C@@H](CC[C@@]2(O3)C)C(=C)C(=O)O4)O
InChI
InChI=1S/C15H20O4/c1-8-9-4-5-14(3)15(19-14)7-6-13(2,17)11(15)10(9)18-12(8)16/h9-11,17H,1,4-7H2,2-3H3/t9-,10-,11-,13+,14-,15+/m0/s1
InChIKey
IFWNFKWDSMXFLK-NCWRXGJMSA-N
Chemical Structure
2D Structure
2D structure of Epoxymicheliolide
CAS: 1343403-10-0
CID: 71490387
Formula: C15H20O4
MW: 264.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight264.32
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass264.13615911
Monoisotopic Mass264.13615911
Topological Polar Surface Area59.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity500
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TQ0234-01Epoxymicheliolide
412349-01Epoxymicheliolide discontinued. See 361784

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