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Perlolyrine

CAT: 0931-TN6548-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-TN6548-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
29700-20-7
Target
Src, MAPK
Related Pathways
Angiogenesis, Tyrosine Kinase/Adaptors, MAPK
Purity
0.9962
Bioactivity
Perlolyrine (Tribulusterine) is a naturally occurring alkaloid with molecular docking capacity (-5.73 to -6.59 kJ/mol) with MAPK1, MAPK14, and SRC, with potential anticancer and anti-inflammatory effects.
Smiles
OCC=1OC(=CC1)C2=NC=CC=3C4=CC=CC=C4NC23
Molecular Formula
C16H12N2O2
Molecular Weight
264.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Perlolyrine

Perlolyrine is an organic molecular entity. It has a role as a metabolite.

CAS Number29700-20-7
PubChem CID160179
IUPAC Name[5-(9H-pyrido[3,4-b]indol-1-yl)furan-2-yl]methanol
Molecular FormulaC16H12N2O2
Molecular Weight264.28
XLogP2.2
Topological Polar Surface Area62.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity351
SMILES
C1=CC=C2C(=C1)C3=C(N2)C(=NC=C3)C4=CC=C(O4)CO
InChI
InChI=1S/C16H12N2O2/c19-9-10-5-6-14(20-10)16-15-12(7-8-17-16)11-3-1-2-4-13(11)18-15/h1-8,18-19H,9H2
InChIKey
KFUCYPGCMLPUMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Perlolyrine
CAS: 29700-20-7
CID: 160179
Formula: C16H12N2O2
MW: 264.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight264.28
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass264.089877630
Monoisotopic Mass264.089877630
Topological Polar Surface Area62.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity351
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

Alternative Products

CatalogName
EBA70020Perlolyrine

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