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Eicosapentaenoyl Serotonin

CAT: 0607-C4082-10Size: 10 mg (Solution)Dry Ice: NoHazardous: No
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CAT#:0607-C4082-10Size:10 mg (Solution)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TRPV1 channel inhibitor
CAS Number
199875-71-3
Product Name Alternative
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-5Z,8Z,11Z,14Z,17Z-eicosapentaenamide
Field of Research
Membrane Transporter Ion Channel TRPV1
Purity
0.98
Form
A solution in ethanol. To change the solvent, simply evaporate the ethanol under a gentle stream of nitrogen and immediately add the solvent of choice.
Solubility
≤20mg/ml in ethanol;20mg/ml in DMSO;20mg/ml in dimethyl formamide
Smiles
O=C(NCCC1=CNC2=CC=C(O)C=C12)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
Molecular Formula
C30H40N2O2
Molecular Weight
460.7
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Eicosapentaenoyl Serotonin
CAS Number199875-71-3
PubChem CID91746210
IUPAC Name(5Z,8Z,11Z,14Z,17Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]icosa-5,8,11,14,17-pentaenamide
Molecular FormulaC30H40N2O2
Molecular Weight460.6
XLogP6.3
Topological Polar Surface Area65.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Heavy Atom Count34
Formal Charge0
Complexity692
SMILES
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCC1=CNC2=C1C=C(C=C2)O
InChI
InChI=1S/C30H40N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(34)31-23-22-26-25-32-29-21-20-27(33)24-28(26)29/h3-4,6-7,9-10,12-13,15-16,20-21,24-25,32-33H,2,5,8,11,14,17-19,22-23H2,1H3,(H,31,34)/b4-3-,7-6-,10-9-,13-12-,16-15-
InChIKey
RYPAMQYLBIIZHL-JLNKQSITSA-N
Chemical Structure
2D Structure
2D structure of Eicosapentaenoyl Serotonin
CAS: 199875-71-3
CID: 91746210
Formula: C30H40N2O2
MW: 460.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight460.6
XLogP36.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Exact Mass460.308978523
Monoisotopic Mass460.308978523
Topological Polar Surface Area65.1 Ų
Heavy Atom Count34
Formal Charge0
Complexity692
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count5
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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