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Physalin A

CAT: 0931-TN4774-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN4774-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23027-91-0
Target
JAK, Autophagy, STAT, mTOR, Apoptosis, p38 MAPK, Akt, NF-κB, PI3K
Related Pathways
NF-κB, Tyrosine Kinase/Adaptors, Autophagy, Angiogenesis, Chromatin/Epigenetic, Stem Cells, MAPK, Cytoskeletal Signaling, PI3K/Akt/mTOR signaling, Apoptosis, JAK/STAT signaling
Purity
0.9971
Bioactivity
Physalin A is an anti-inflammatory compound isolated from P. alkekengi with anti-fibrotic effects, regulating the Nrf2 pathway through ERK and p38 to induce detoxification enzymes. Physalin A blocks the activation of the NF-kappaB signaling pathway. Physalin A reduces mammosphere formation by reducing the expression of the GLI1 gene and the YAP1 gene.
Smiles
C[C@@]12[C@]34[C@]([C@]5(C)C[C@]1(OC(=O)C5=C)[H])(C(=O)[C@](O)(O3)[C@]6([C@](CC[C@]4(O)C(=O)O2)([C@]7(C)C(=C[C@H]6O)CC=CC7=O)[H])[H])[H]
Molecular Formula
C28H30O10
Molecular Weight
526.53
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Physalin A

Physalin A is a physalin.

CAS Number23027-91-0
PubChem CID44577487
IUPAC Name(1S,2S,3R,5R,6S,7R,14R,15S,18R,21S,22R)-5,7,18-trihydroxy-1,14,21-trimethyl-25-methylidene-4,20,23-trioxaheptacyclo[20.3.1.12,5.03,18.03,21.06,15.09,14]heptacosa-8,11-diene-13,19,24,27-tetrone
Molecular FormulaC28H30O10
Molecular Weight526.5
XLogP0
Topological Polar Surface Area157
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Heavy Atom Count38
Formal Charge0
Complexity1350
SMILES
C[C@]12C[C@H]([C@]3([C@]45[C@H]1C(=O)[C@](O4)([C@H]6[C@H](CC[C@@]5(C(=O)O3)O)[C@@]7(C(=C[C@H]6O)CC=CC7=O)C)O)C)OC(=O)C2=C
InChI
InChI=1S/C28H30O10/c1-12-21(32)36-17-11-23(12,2)19-20(31)27(35)18-14(24(3)13(10-15(18)29)6-5-7-16(24)30)8-9-26(34)22(33)37-25(17,4)28(19,26)38-27/h5,7,10,14-15,17-19,29,34-35H,1,6,8-9,11H2,2-4H3/t14-,15+,17+,18-,19-,23+,24-,25-,26-,27+,28-/m0/s1
InChIKey
VELDODQHYQSJOF-RPKVKFPNSA-N
Chemical Structure
2D Structure
2D structure of Physalin A
CAS: 23027-91-0
CID: 44577487
Formula: C28H30O10
MW: 526.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight526.5
XLogP30
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Exact Mass526.18389715
Monoisotopic Mass526.18389715
Topological Polar Surface Area157 Ų
Heavy Atom Count38
Formal Charge0
Complexity1350
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