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1,5-Dihydroxy-6,7-dimethoxyxanthone

CAT: 0931-TN5907Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN5907Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
38710-31-5
Bioactivity
1,5-Dihydroxy-6,7-dimethoxyxanthone is a natural product for research related to life sciences. The catalog number is TN5907 and the CAS number is 38710-31-5.
Smiles
COc1cc2c(oc3cccc(O)c3c2=O)c(O)c1OC
Molecular Formula
C15H12O6
Molecular Weight
288.255
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1,5-Dihydroxy-6,7-dimethoxyxanthone

1,5-dihydroxy-6,7-dimethoxyxanthen-9-one has been reported in Hypericum japonicum, Tovomita brasiliensis, and other organisms with data available.

CAS Number38710-31-5
PubChem CID101631689
IUPAC Name1,5-dihydroxy-6,7-dimethoxyxanthen-9-one
Molecular FormulaC15H12O6
Molecular Weight288.25
XLogP2.7
Topological Polar Surface Area85.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity400
SMILES
COC1=C(C(=C2C(=C1)C(=O)C3=C(C=CC=C3O2)O)O)OC
InChI
InChI=1S/C15H12O6/c1-19-10-6-7-12(17)11-8(16)4-3-5-9(11)21-14(7)13(18)15(10)20-2/h3-6,16,18H,1-2H3
InChIKey
HJFHTGGYJGLTDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,5-Dihydroxy-6,7-dimethoxyxanthone
CAS: 38710-31-5
CID: 101631689
Formula: C15H12O6
MW: 288.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight288.25
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass288.06338810
Monoisotopic Mass288.06338810
Topological Polar Surface Area85.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity400
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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