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KukoaMine B

CAT: 0931-T7026-02Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T7026-02Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
164991-67-7
Target
PI3K, ROS, DNA/RNA Synthesis, Antioxidant, p38 MAPK, Apoptosis, Akt, MAPK, MMP
Related Pathways
Immunology/Inflammation, MAPK, PI3K/Akt/mTOR signaling, Cell Cycle/Checkpoint, Apoptosis, Cytoskeletal Signaling, Oxidation-Reduction, DNA Damage/DNA Repair, Proteases/Proteasome
Purity
0.9959
Bioactivity
Kukoamine B, as a constituent of Lycii Cortex, exhibits anti-acute inflammatory, anti-oxidant, and anti-diabetic characteristics.
Smiles
NCCCN(CCCCNCCCNC(=O)CCc1ccc(O)c(O)c1)C(=O)CCc1ccc(O)c(O)c1
Molecular Formula
C28H42N4O6
Molecular Weight
530.66
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Kukoamine B

Kukoamine B is an amine.

CAS Number164991-67-7
PubChem CID10346914
IUPAC NameN-[3-[4-[3-aminopropyl-[3-(3,4-dihydroxyphenyl)propanoyl]amino]butylamino]propyl]-3-(3,4-dihydroxyphenyl)propanamide
Molecular FormulaC28H42N4O6
Molecular Weight530.7
XLogP1.5
Topological Polar Surface Area168
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count8
Rotatable Bond Count18
Heavy Atom Count38
Formal Charge0
Complexity669
SMILES
C1=CC(=C(C=C1CCC(=O)NCCCNCCCCN(CCCN)C(=O)CCC2=CC(=C(C=C2)O)O)O)O
InChI
InChI=1S/C28H42N4O6/c29-13-3-18-32(28(38)12-8-22-6-10-24(34)26(36)20-22)17-2-1-14-30-15-4-16-31-27(37)11-7-21-5-9-23(33)25(35)19-21/h5-6,9-10,19-20,30,33-36H,1-4,7-8,11-18,29H2,(H,31,37)
InChIKey
IWRAOCFRRTWUDF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kukoamine B
CAS: 164991-67-7
CID: 10346914
Formula: C28H42N4O6
MW: 530.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight530.7
XLogP31.5
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count8
Rotatable Bond Count18
Exact Mass530.31043507
Monoisotopic Mass530.31043507
Topological Polar Surface Area168 Ų
Heavy Atom Count38
Formal Charge0
Complexity669
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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300534Kukoamine A
AB0306KukoaMine B
HY-N2392RKukoamine A (Standard)
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