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2,5-Dihydroxy-1-methoxyxanthone

CAT: 0804-HY-N8702Size: 1 EachDry Ice: NoHazardous: No
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Description
2,5-Dihydroxy-1-methoxyxanthone is a Xanthones product that can be isolated from the twigs of Mammea siamensis.[1].
CAS Number
173220-32-1
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/2-5-dihydroxy-1-methoxyxanthone.html
Smiles
O=C1C2=C(OC3=CC=C(C(OC)=C13)O)C(O)=CC=C2
Molecular Formula
C14H10O5
Molecular Weight
258.23
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

2,5-Dihydroxy-1-methoxyxanthone

2,5-dihydroxy-1-methoxyxanthen-9-one has been reported in Hypericum japonicum, Garcinia subelliptica, and other organisms with data available.

CAS Number173220-32-1
PubChem CID10848779
IUPAC Name2,5-dihydroxy-1-methoxyxanthen-9-one
Molecular FormulaC14H10O5
Molecular Weight258.23
XLogP2.2
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity358
SMILES
COC1=C(C=CC2=C1C(=O)C3=C(O2)C(=CC=C3)O)O
InChI
InChI=1S/C14H10O5/c1-18-14-9(16)5-6-10-11(14)12(17)7-3-2-4-8(15)13(7)19-10/h2-6,15-16H,1H3
InChIKey
AIXALMAGQFXNBO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dihydroxy-1-methoxyxanthone
CAS: 173220-32-1
CID: 10848779
Formula: C14H10O5
MW: 258.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.23
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass258.05282342
Monoisotopic Mass258.05282342
Topological Polar Surface Area76 Ų
Heavy Atom Count19
Formal Charge0
Complexity358
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

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