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Physalin B

CAT: 0931-TN2063-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN2063-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23133-56-4
Target
Autophagy, NOD, Apoptosis, Akt, NF-κB, Nrf2, PI3K
Related Pathways
Autophagy, Apoptosis, PI3K/Akt/mTOR signaling, NF-κB, Immunology/Inflammation, Cytoskeletal Signaling
Purity
0.984
Bioactivity
Physalin B is one of the major active compounds from the Solanaceae family of plants and has a wide range of biological activities for the treatment of inflammatory eczema and herpes, among other diseases.Physalin B ameliorates lipopolysaccharide-induced inflammatory response due to acute lung injury by inhibiting NF-κB and NLRP3 through activation of the PI3K/Akt pathway.Physalin B inhibits PDGF-BB-induced VSMC proliferation and migration and phenotypic transformation through activation of the Nrf2 pathway. Physalin B inhibits PDGF-BB-induced VSMC proliferation, migration and phenotypic transformation through activation of the Nrf2 pathway.Physalin B exerts antitumor activity by inhibiting LAP2α-HDAC1-mediated deacetylation of glioma-associated oncogene 1 and hepatic stellate cell activation.
Smiles
[H][C@@]12C(=O)[C@]34O[C@]11[C@@](C)(OC(=O)[C@@]1(O)CC[C@@]1([H])[C@@]3([H])CC=C3CC=CC(=O)[C@]13C)[C@H]1C[C@]2(C)[C@@]([H])(CO4)C(=O)O1
Molecular Formula
C28H30O9
Molecular Weight
510.53
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Physalin B

CID 11613161 has been reported in Witheringia solanacea, Alkekengi officinarum, and other organisms with data available.

CAS Number23133-56-4
PubChem CID11613161
IUPAC Name(1R,2S,5R,8S,9R,17R,18R,21S,24R,26S,27S)-5-hydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacosa-11,14-diene-4,10,22,29-tetrone
Molecular FormulaC28H30O9
Molecular Weight510.5
XLogP0.8
Topological Polar Surface Area125
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count0
Heavy Atom Count37
Formal Charge0
Complexity1300
SMILES
C[C@]12C[C@@H]3[C@]4([C@]56[C@H]1C(=O)[C@](O5)([C@@H]7CC=C8CC=CC(=O)[C@@]8([C@H]7CC[C@@]6(C(=O)O4)O)C)OC[C@H]2C(=O)O3)C
InChI
InChI=1S/C28H30O9/c1-23-11-18-25(3)28-19(23)20(30)27(37-28,34-12-16(23)21(31)35-18)15-8-7-13-5-4-6-17(29)24(13,2)14(15)9-10-26(28,33)22(32)36-25/h4,6-7,14-16,18-19,33H,5,8-12H2,1-3H3/t14-,15+,16-,18+,19-,23+,24-,25-,26-,27+,28-/m0/s1
InChIKey
HVTFEHJSUSPQBK-DNJDGUCCSA-N
Chemical Structure
2D Structure
2D structure of Physalin B
CAS: 23133-56-4
CID: 11613161
Formula: C28H30O9
MW: 510.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight510.5
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count0
Exact Mass510.18898253
Monoisotopic Mass510.18898253
Topological Polar Surface Area125 Ų
Heavy Atom Count37
Formal Charge0
Complexity1300
Isotope Atom Count0
Defined Atom Stereocenter Count11
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes