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Etretinate

CAT: 0931-T6831-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T6831-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
54350-48-0
Target
Apoptosis
Related Pathways
Apoptosis
Purity
0.9948
Bioactivity
Etretinate (Ro 10-9359) is an oral aromatic retinoid acid which is effective in psoriasis and other dermatological syndromes. It activates retinoid receptors, causing an induction of cell differentiation, inhibition of cell proliferation, and inhibition of tissue infiltration by inflammatory cells.
Smiles
CCOC(=O)\C=C(/C)\C=C\C=C(/C)\C=C\c1c(C)cc(OC)c(C)c1C
Molecular Formula
C23H30O3
Molecular Weight
354.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Etretinate

Etretinate can cause developmental toxicity according to an independent committee of scientific and health experts.

CAS Number54350-48-0
PubChem CID5282375
IUPAC Nameethyl (2E,4E,6E,8E)-9-(4-methoxy-2,3,6-trimethylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoate
Molecular FormulaC23H30O3
Molecular Weight354.5
XLogP6.8
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity568
SMILES
CCOC(=O)/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C(=C(C=C1C)OC)C)C
InChI
InChI=1S/C23H30O3/c1-8-26-23(24)14-17(3)11-9-10-16(2)12-13-21-18(4)15-22(25-7)20(6)19(21)5/h9-15H,8H2,1-7H3/b11-9+,13-12+,16-10+,17-14+
InChIKey
HQMNCQVAMBCHCO-DJRRULDNSA-N
Chemical Structure
2D Structure
2D structure of Etretinate
CAS: 54350-48-0
CID: 5282375
Formula: C23H30O3
MW: 354.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.5
XLogP36.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass354.21949481
Monoisotopic Mass354.21949481
Topological Polar Surface Area35.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity568
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count4
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

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A16356-25Etretinate 25mg

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