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Cotoin

CAT: 0804-HY-N3637-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N3637-01Size:1 mg
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Description
Cotoin is a natural product isolated from the stem bark of Garcinia virgate[1].
CAS Number
479-21-0
UNSPSC
12352005
Hazard Statement
H315-H319
Target
Others
Type
Natural Products
Related Pathways
Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/cotoin.html
Solubility
10 mM in DMSO
Smiles
O=C(C1=C(O)C=C(OC)C=C1O)C2=CC=CC=C2
Molecular Formula
C14H12O4
Molecular Weight
244.24
Precautions
P264-P280-P302+P352-P305+P351+P338-P362+P364
References & Citations
[1]Merza J, et al. Prenylated xanthones and tocotrienols from Garcinia virgata. Phytochemistry. 2004 Nov;65 (21) :2915-20.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Cotoin
CAS Number479-21-0
PubChem CID10175
IUPAC Name(2,6-dihydroxy-4-methoxyphenyl)-phenylmethanone
Molecular FormulaC14H12O4
Molecular Weight244.24
XLogP3.1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity274
SMILES
COC1=CC(=C(C(=C1)O)C(=O)C2=CC=CC=C2)O
InChI
InChI=1S/C14H12O4/c1-18-10-7-11(15)13(12(16)8-10)14(17)9-5-3-2-4-6-9/h2-8,15-16H,1H3
InChIKey
HNJZOHHIXSIJFG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cotoin
CAS: 479-21-0
CID: 10175
Formula: C14H12O4
MW: 244.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight244.24
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass244.07355886
Monoisotopic Mass244.07355886
Topological Polar Surface Area66.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity274
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
MBS5760262Cotoin