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Neoprzewaquinone A

CAT: 1410-M31031-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Neoprzewaquinone A has algicidal effect on M. aeruginosa , with EC50 of 4.68 mg /L, the potential inhibition mechanisms are neo-przewaquinone A caused M. aeruginosa cells morphologic damage or lysis.
CAS Number
630057-39-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
556.6
Molecular Formula
C36H28O6
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Neoprzewaquinone A

CID 124222343 has been reported in Salvia przewalskii with data available.

CAS Number630057-39-5
PubChem CID124222343
IUPAC Name(2Z)-2,11,28-trimethyl-19-methylidene-13,30-dioxaheptacyclo[21.11.0.06,18.07,15.010,14.024,32.027,31]tetratriaconta-1(23),2,6(18),7(15),10(14),11,16,24(32),27(31),28,33-undecaene-8,9,25,26-tetrone
Molecular FormulaC36H28O6
Molecular Weight556.6
XLogP6.4
Topological Polar Surface Area94.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count42
Formal Charge0
Complexity1220
SMILES
C/C/1=C/CCC2=C(C=CC3=C2C(=O)C(=O)C4=C3OC=C4C)C(=C)CCCC5=C1C=CC6=C5C(=O)C(=O)C7=C6OC=C7C
InChI
InChI=1S/C36H28O6/c1-17-7-5-9-24-22(12-14-26-30(24)34(40)32(38)28-20(4)16-42-36(26)28)18(2)8-6-10-23-21(17)11-13-25-29(23)33(39)31(37)27-19(3)15-41-35(25)27/h8,11-16H,1,5-7,9-10H2,2-4H3/b18-8-
InChIKey
SXQCYGZVSVUMEL-LSCVHKIXSA-N
Chemical Structure
2D Structure
2D structure of Neoprzewaquinone A
CAS: 630057-39-5
CID: 124222343
Formula: C36H28O6
MW: 556.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight556.6
XLogP36.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass556.18858861
Monoisotopic Mass556.18858861
Topological Polar Surface Area94.6 Ų
Heavy Atom Count42
Formal Charge0
Complexity1220
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
CS-BT-00469Neoprzewaquinone A
371724Neoprzewaquinone A discontinued

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