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NAP1051

CAT: 0013-GTR19237724-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237724-02Size:50 mg
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Description
NAP1051 is a biomimetic Lipoxin A4 analog that modulates the inflammatory tumor microenvironment, inhibiting neutrophil chemotaxis and promoting macrophage efferocytosis via AKT activation. It is a research tool for studying colorectal cancer mechanisms in both in vitro and in vivo models.
CAS Number
864516-77-8
Field of Research
Signal Transduction
Smiles
C (=C/[C@H] ([C@H] (CCCC (OC) =O) O) O) \C1=CC (/C=C/[C@@H] (CCCCC) O) =CC=C1
Molecular Formula
C23H34O5
Molecular Weight
390.51
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

methyl (E,5S,6R)-5,6-dihydroxy-8-[3-[(E,3R)-3-hydroxyoct-1-enyl]phenyl]oct-7-enoate
CAS Number864516-77-8
PubChem CID11976206
IUPAC Namemethyl (E,5S,6R)-5,6-dihydroxy-8-[3-[(E,3R)-3-hydroxyoct-1-enyl]phenyl]oct-7-enoate
Molecular FormulaC23H34O5
Molecular Weight390.5
XLogP3.8
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Heavy Atom Count28
Formal Charge0
Complexity474
SMILES
CCCCC[C@H](/C=C/C1=CC(=CC=C1)/C=C/[C@H]([C@H](CCCC(=O)OC)O)O)O
InChI
InChI=1S/C23H34O5/c1-3-4-5-10-20(24)15-13-18-8-6-9-19(17-18)14-16-22(26)21(25)11-7-12-23(27)28-2/h6,8-9,13-17,20-22,24-26H,3-5,7,10-12H2,1-2H3/b15-13+,16-14+/t20-,21+,22-/m1/s1
InChIKey
BGMWMUFLETWNBH-QMHAZQIESA-N
Chemical Structure
2D Structure
2D structure of methyl (E,5S,6R)-5,6-dihydroxy-8-[3-[(E,3R)-3-hydroxyoct-1-enyl]phenyl]oct-7-enoate
CAS: 864516-77-8
CID: 11976206
Formula: C23H34O5
MW: 390.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight390.5
XLogP33.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass390.24062418
Monoisotopic Mass390.24062418
Topological Polar Surface Area87 Ų
Heavy Atom Count28
Formal Charge0
Complexity474
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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