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7-O-Methyleriodictyol

CAT: 0013-GTR19164639-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164639-01Size:1 mg
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Description
7-O-Methyleriodictyol
CAS Number
51857-11-5
Product Name Alternative
AChR, 7 O Methyleriodictyol, 7OMethyleriodictyol, 7-O-Methyleriodictyol
Field of Research
Infectious Disease & Virology, Neuroscience
Purity
98.10% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (3.31 mM) ; DMSO:30.23 mg/mL (100.01 mM)
Smiles
O=C1C=2C (O[C@@H] (C1) C3=CC (O) =C (O) C=C3) =CC (OC) =CC2O
Molecular Formula
C16H14O6
Molecular Weight
302.28
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Sternbin
CAS Number51857-11-5
PubChem CID4872981
IUPAC Name2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-2,3-dihydrochromen-4-one
Molecular FormulaC16H14O6
Molecular Weight302.28
XLogP2.4
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity413
SMILES
COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC(=C(C=C3)O)O)O
InChI
InChI=1S/C16H14O6/c1-21-9-5-12(19)16-13(20)7-14(22-15(16)6-9)8-2-3-10(17)11(18)4-8/h2-6,14,17-19H,7H2,1H3
InChIKey
DSAJORLEPQBKDA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sternbin
CAS: 51857-11-5
CID: 4872981
Formula: C16H14O6
MW: 302.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight302.28
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass302.07903816
Monoisotopic Mass302.07903816
Topological Polar Surface Area96.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity413
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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