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MM-22

CAT: 0013-GTR19201122-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201122-02Size:50 mg
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Description
This biotin-tagged anandamide analog serves as a research probe for tracking the uptake and subcellular transport of the endocannabinoid anandamide. It is a valuable tool for visualizing lipid signaling dynamics in both live-cell (in vitro) and tissue-based studies, aiding research in neuroscience and immunology.
CAS Number
956605-71-3
Field of Research
Pharmacology & Drug Discovery
Smiles
C (CCCC (NCCOCCOCCNC (CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC) =O) =O) [C@H]1[C@@]2 ([C@] (CS1) (NC (=O) N2) [H]) [H]
Molecular Formula
C36H60N4O5S
Molecular Weight
660.95
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Biotin anandamide
CAS Number956605-71-3
PubChem CID17755658
IUPAC Name(5Z,8Z,11Z,14Z)-N-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethyl]icosa-5,8,11,14-tetraenamide
Molecular FormulaC36H60N4O5S
Molecular Weight661.0
XLogP5.6
Topological Polar Surface Area143
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count28
Heavy Atom Count46
Formal Charge0
Complexity955
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCOCCOCCNC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2
InChI
InChI=1S/C36H60N4O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-33(41)37-24-26-44-28-29-45-27-25-38-34(42)23-20-19-21-32-35-31(30-46-32)39-36(43)40-35/h6-7,9-10,12-13,15-16,31-32,35H,2-5,8,11,14,17-30H2,1H3,(H,37,41)(H,38,42)(H2,39,40,43)/b7-6-,10-9-,13-12-,16-15-/t31-,32-,35-/m0/s1
InChIKey
OWGIWGPEYRGLKI-CJBBQPGESA-N
Chemical Structure
2D Structure
2D structure of Biotin anandamide
CAS: 956605-71-3
CID: 17755658
Formula: C36H60N4O5S
MW: 661.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight661.0
XLogP35.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count28
Exact Mass660.42844220
Monoisotopic Mass660.42844220
Topological Polar Surface Area143 Ų
Heavy Atom Count46
Formal Charge0
Complexity955
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count4
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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