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Pentagamavunon-1

CAT: 0931-T61181-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-T61181-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
27060-70-4
Target
Others, COX, Apoptosis, NF-κB, VEGFR
Related Pathways
Neuroscience, Tyrosine Kinase/Adaptors, Angiogenesis, Immunology/Inflammation, Others, Apoptosis, NF-κB
Bioactivity
Pentagamavunon-1 (PGV-1) is an oral Curcumin analog that effectively induces apoptosis through multiple molecular mechanisms. It primarily targets and inhibits key angiogenic factors, including cyclooxygenase-2 (COX-2) and vascular endothelial growth factor (VEGF), which play crucial roles in mediating cell proliferation and survival. Additionally, PGV-1 possesses the ability to inhibit the activation of NF-κB, further enhancing its apoptotic effects. [1]
Smiles
Cc1cc(\C=C2/CC\C(=C/c3cc(C)c(O)c(C)c3)C2=O)cc(C)c1O
Molecular Formula
C23H24O3
Molecular Weight
348.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pentagamavunon-1
CAS Number27060-70-4
PubChem CID10760152
IUPAC Name(2E,5E)-2,5-bis[(4-hydroxy-3,5-dimethylphenyl)methylidene]cyclopentan-1-one
Molecular FormulaC23H24O3
Molecular Weight348.4
XLogP5.3
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity516
SMILES
CC1=CC(=CC(=C1O)C)/C=C\2/C(=O)/C(=C/C3=CC(=C(C(=C3)C)O)C)/CC2
InChI
InChI=1S/C23H24O3/c1-13-7-17(8-14(2)21(13)24)11-19-5-6-20(23(19)26)12-18-9-15(3)22(25)16(4)10-18/h7-12,24-25H,5-6H2,1-4H3/b19-11+,20-12+
InChIKey
OHSKJRMWVIVJCP-AYKLPDECSA-N
Chemical Structure
2D Structure
2D structure of Pentagamavunon-1
CAS: 27060-70-4
CID: 10760152
Formula: C23H24O3
MW: 348.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight348.4
XLogP35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass348.17254462
Monoisotopic Mass348.17254462
Topological Polar Surface Area57.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity516
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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BA3070-100Pentagamavunon-1
OF59775-011,1,1,1,1-Kestoheptaose
N2864-5.11,1,1,1-Kestohexaose
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