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δ-CEHC

CAT: 0931-T87700-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T87700-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
84599-16-6
Target
Endogenous Metabolite
Related Pathways
Metabolism
Bioactivity
δ-CEHC, a δ-tocopherol metabolite, exhibits antioxidant activity [1].
Smiles
CC1=C2C(CCC(CCC(O)=O)(C)O2)=CC(O)=C1
Molecular Formula
C14H18O4
Molecular Weight
250.29
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

delta-CEHC

Delta-CEHC is a 1-benzopyran.

CAS Number84599-16-6
PubChem CID11536125
IUPAC Name3-(6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl)propanoic acid
Molecular FormulaC14H18O4
Molecular Weight250.29
XLogP2.4
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity317
SMILES
CC1=CC(=CC2=C1OC(CC2)(C)CCC(=O)O)O
InChI
InChI=1S/C14H18O4/c1-9-7-11(15)8-10-3-5-14(2,18-13(9)10)6-4-12(16)17/h7-8,15H,3-6H2,1-2H3,(H,16,17)
InChIKey
BNVXCCQXUZCRSR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of delta-CEHC
CAS: 84599-16-6
CID: 11536125
Formula: C14H18O4
MW: 250.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight250.29
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass250.12050905
Monoisotopic Mass250.12050905
Topological Polar Surface Area66.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity317
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TMAS-00219-01Anti-CEH Antibody (7X896)
T80121-01Ac- (d-Arg) -CEH- (d-Phe) -RWC-NH2

Alternative Products

CatalogName
sc-223880γ-CEHC
sc-222435δ-CEHC
sc-222430α-CEHC
TRC-C249200-25MGgamma-CEHC
HY-113269-01Alpha-CEHC
HY-113095Sγ-CEHC-d5
HY-113095Rγ-CEHC (Standard)
900106Alpha CEHC
TRC-C249202-10MGGamma-CEHC-d5
900106BAAlpha CEHC-BSA

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