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Chrysoobtusin

CAT: 1410-M21313-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M21313-02Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Chrysoobtusin belongs to the class of organic compounds known as hydroxyanthraquinones.
CAS Number
70588-06-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
358.3
Molecular Formula
C19H18O7
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Chrysoobtusin

Chryso-obtusin is a monohydroxyanthraquinone.

CAS Number70588-06-6
PubChem CID155381
IUPAC Name2-hydroxy-1,6,7,8-tetramethoxy-3-methylanthracene-9,10-dione
Molecular FormulaC19H18O7
Molecular Weight358.3
XLogP2.8
Topological Polar Surface Area91.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity550
SMILES
CC1=CC2=C(C(=C1O)OC)C(=O)C3=C(C(=C(C=C3C2=O)OC)OC)OC
InChI
InChI=1S/C19H18O7/c1-8-6-9-12(18(25-4)14(8)20)16(22)13-10(15(9)21)7-11(23-2)17(24-3)19(13)26-5/h6-7,20H,1-5H3
InChIKey
ZMDXTRSTKHTSCE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chrysoobtusin
CAS: 70588-06-6
CID: 155381
Formula: C19H18O7
MW: 358.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.3
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass358.10525291
Monoisotopic Mass358.10525291
Topological Polar Surface Area91.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity550
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
T8254-01Chrysoobtusin
HY-N10944Chrysoobtusin 2-β-D-glucoside

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