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Ponicidin

CAT: 0931-T2S1975-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T2S1975-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
52617-37-5
Target
JAK, STAT, Apoptosis
Related Pathways
Tyrosine Kinase/Adaptors, Chromatin/Epigenetic, Stem Cells, Apoptosis, Angiogenesis, JAK/STAT signaling
Purity
0.9992
Bioactivity
Ponicidin (Rubescensine B) is a diterpenoid derived from Rabdosia rubescens that exhibits immunoregulatory, anti-inflammatory, anti-viral, and anti-cancer activity. Ponicidin induces apoptosis of gastric carcinoma cells, decreases the phosphorylation of JAK2 and STAT3, and shows no effect on the protein levels of JAK2 and STAT3.
Smiles
[H][C@]12CC[C@]3([H])[C@]4(C(=O)C1=C)[C@@]2([H])O[C@@]1([H])O[C@]4(O)[C@@H](O)[C@]2([H])C(C)(C)CC[C@H](O)C312
Molecular Formula
C20H26O6
Molecular Weight
362.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ponicidin

from the stems and leaves of Rabdosa nervosa

CAS Number52617-37-5
PubChem CID124223327
IUPAC Name(2S,5S,8R,9S,11S,13S,14S,15R,19S)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one
Molecular FormulaC20H26O6
Molecular Weight362.4
XLogP0.6
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count26
Formal Charge0
Complexity761
SMILES
CC1(CC[C@@H](C23[C@@H]1[C@@H]([C@@]4([C@]56[C@H]2CC[C@H]([C@@H]5O[C@H]3O4)C(=C)C6=O)O)O)O)C
InChI
InChI=1S/C20H26O6/c1-8-9-4-5-10-18-11(21)6-7-17(2,3)12(18)14(23)20(24)19(10,13(8)22)15(9)25-16(18)26-20/h9-12,14-16,21,23-24H,1,4-7H2,2-3H3/t9-,10-,11-,12+,14-,15-,16-,18?,19-,20+/m0/s1
InChIKey
WHRDRHNMTIXZNY-AMOJAPPFSA-N
Chemical Structure
2D Structure
2D structure of Ponicidin
CAS: 52617-37-5
CID: 124223327
Formula: C20H26O6
MW: 362.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.4
XLogP30.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass362.17293854
Monoisotopic Mass362.17293854
Topological Polar Surface Area96.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity761
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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