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(Rac) -SC-45694

CAT: 0804-HY-123014Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-123014Size:1 Each
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Description
(Rac) -SC-45694 is a racemate of SC-45694. SC-45694 has full LTB4 agonist activity for neutrophil chemotaxis and has antagonist activity against LTB4-induced neutrophil degranulation[1].
CAS Number
120772-66-9
UNSPSC
12352005
Target
Leukotriene Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/rac-sc-45694.html
Smiles
O=C(CCCC(/C=C/C1=CC=C(C=C1)C(C/C=C/CCCCC)O)O)O[Li]
Molecular Formula
C22H31LiO4
Molecular Weight
366.42
References & Citations
[1]Tsai BS, et al. The leukotriene B4 receptor agonist/antagonist activities of SC-45694 in human neutrophils. J Pharmacol Exp Ther. 1994 Mar;268 (3) :1493-8.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

SC 45694

structure in first source; leukotriene B4 receptor antagonist

CAS Number120772-66-9
PubChem CID23688334
IUPAC Namelithium (E)-5-hydroxy-7-[4-[(E)-1-hydroxynon-3-enyl]phenyl]hept-6-enoate
Molecular FormulaC22H31LiO4
Molecular Weight366.4
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Heavy Atom Count27
Formal Charge0
Complexity428
SMILES
[Li+].CCCCC/C=C/CC(C1=CC=C(C=C1)/C=C/C(CCCC(=O)[O-])O)O
InChI
InChI=1S/C22H32O4.Li/c1-2-3-4-5-6-7-10-21(24)19-15-12-18(13-16-19)14-17-20(23)9-8-11-22(25)26;/h6-7,12-17,20-21,23-24H,2-5,8-11H2,1H3,(H,25,26);/q;+1/p-1/b7-6+,17-14+;
InChIKey
KBGYGADKVYHWBW-FKRNLGTASA-M
Chemical Structure
2D Structure
2D structure of SC 45694
CAS: 120772-66-9
CID: 23688334
Formula: C22H31LiO4
MW: 366.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Exact Mass366.23823790
Monoisotopic Mass366.23823790
Topological Polar Surface Area80.6 Ų
Heavy Atom Count27
Formal Charge0
Complexity428
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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CatalogName
MBS5784059SC 45694
sc-51694SC (SC-05)
MD023023-12SC-PEG12-SC
HO023023-1K-01SC-PEG-SC, 1K
HO023023-4K-01SC-PEG-SC, 4K
HO023023-500-01SC-PEG-SC, 500
HO023023-800-01SC-PEG-SC, 800
HO023023-6K-01SC-PEG-SC, 6K
HO023023-8K-01SC-PEG-SC, 8K
HO023023-10K-01SC-PEG-SC, 10K

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