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Orthosporin

CAT: 0804-HY-W751002Size: 1 EachDry Ice: NoHazardous: No
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Description
Orthosporin ((+) -Orthosporin), a phytotoxic isocoumarin compound, is a microbial secondary metabolite. Orthosporin can be isolated from the endophytic fungus Lasiodiplodia tbeobromae. Orthosporin has potent antibacterial activity against B. subtilis, E. coli and P. aeruginosa. Orthosporin also has antioxidant activity against DPPH radical and antiviral activities with inhibition of HIV-1 reverse transcriptase activity[1].
CAS Number
118063-79-9
Product Name Alternative
(+) -Orthosporin
UNSPSC
12352005
Target
Bacterial; Endogenous Metabolite; HIV; Reverse Transcriptase
Related Pathways
Anti-infection; Metabolic Enzyme/Protease
Applications
COVID-19-anti-virus
Field of Research
Infection
Smiles
O=C1C2=C(C=C(C=C2C=C(C[C@H](C)O)O1)O)O
Molecular Formula
C12H12O5
Molecular Weight
236.22
References & Citations
[1]Okezie U M, et al. Orthosporin, a major component of the fermentation product of Lasiodiplodia theobromae-an endophytic fungus of Musa paradisiaca as a potential antimicrobial agent[J]. Notulae Scientia Biologicae, 2022, 14 (2) : 11084-11084.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported
Isoform
HIV-1

Chemical Information

Orthosporin

Orthosporin is a member of isocoumarins.

CAS Number118063-79-9
PubChem CID5281568
IUPAC Name6,8-dihydroxy-3-[(2S)-2-hydroxypropyl]isochromen-1-one
Molecular FormulaC12H12O5
Molecular Weight236.22
XLogP1.8
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity338
SMILES
C[C@@H](CC1=CC2=CC(=CC(=C2C(=O)O1)O)O)O
InChI
InChI=1S/C12H12O5/c1-6(13)2-9-4-7-3-8(14)5-10(15)11(7)12(16)17-9/h3-6,13-15H,2H2,1H3/t6-/m0/s1
InChIKey
XXDAFMSOQNYLBY-LURJTMIESA-N
Chemical Structure
2D Structure
2D structure of Orthosporin
CAS: 118063-79-9
CID: 5281568
Formula: C12H12O5
MW: 236.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight236.22
XLogP31.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass236.06847348
Monoisotopic Mass236.06847348
Topological Polar Surface Area87 Ų
Heavy Atom Count17
Formal Charge0
Complexity338
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19279230-01Orthosporin

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