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Cimifugin

CAT: 1410-M18493-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M18493-02Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Cimifugin inhibits NO production induced by lipopolysaccharide in macrophage cell line RAW 264.7 and for 1, 1-diphenyl-2-picrylhydrazyl free-radical scavenging activity in cell-free bioassay system.
CAS Number
37921-38-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
306.3
Molecular Formula
C16H18O6
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Cimifugin

Cimifugin is an organic heterotricyclic compound and an oxacycle.

CAS Number37921-38-3
PubChem CID441960
IUPAC Name(2S)-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-4-methoxy-2,3-dihydrofuro[3,2-g]chromen-5-one
Molecular FormulaC16H18O6
Molecular Weight306.31
XLogP0.6
Topological Polar Surface Area85.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity485
SMILES
CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2OC)C(=O)C=C(O3)CO)O
InChI
InChI=1S/C16H18O6/c1-16(2,19)13-5-9-11(22-13)6-12-14(15(9)20-3)10(18)4-8(7-17)21-12/h4,6,13,17,19H,5,7H2,1-3H3/t13-/m0/s1
InChIKey
ATDBDSBKYKMRGZ-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of Cimifugin
CAS: 37921-38-3
CID: 441960
Formula: C16H18O6
MW: 306.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.31
XLogP30.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass306.11033829
Monoisotopic Mass306.11033829
Topological Polar Surface Area85.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity485
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T3383-01Cimifugin
HY-N0634R-01Cimifugin (Standard)
300076Cimifugin discontinued. See 269510
MBS3609125-01Cimifugin beta-D-glucopyranoside
TN1496Cimifugin 4'-O-β-D-glucopyranoside

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