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Linaroside

CAT: 0013-GTR19155469-04Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19155469-04Size:1 g
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Description
Linaroside exhibited 30% inhibition for antimycobacterial activity against Mycobacterium tuberculosis, strain H (37) Rv at 6.25 microg mL (-1) concentration.
CAS Number
53452-12-3
Purity
>98% (HPLC)
Smiles
COc (cc1) ccc1C (Oc (c1c2O) cc (O[C@@H] ([C@@H] ([C@H]3O) O) O[C@H] (CO) [C@H]3O) c2OC) =CC1=O
Molecular Formula
C23H24O11
Molecular Weight
476.43
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Linaroside

Linaroside has been reported in Iris spuria, Linaria sessilis, and other organisms with data available.

CAS Number53452-12-3
PubChem CID11972339
IUPAC Name5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC23H24O11
Molecular Weight476.4
XLogP1.2
Topological Polar Surface Area164
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Heavy Atom Count34
Formal Charge0
Complexity736
SMILES
COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC)O
InChI
InChI=1S/C23H24O11/c1-30-11-5-3-10(4-6-11)13-7-12(25)17-14(32-13)8-15(22(31-2)19(17)27)33-23-21(29)20(28)18(26)16(9-24)34-23/h3-8,16,18,20-21,23-24,26-29H,9H2,1-2H3/t16-,18-,20+,21-,23-/m1/s1
InChIKey
JNNRILAYMZYEQB-FZFRBNDOSA-N
Chemical Structure
2D Structure
2D structure of Linaroside
CAS: 53452-12-3
CID: 11972339
Formula: C23H24O11
MW: 476.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.4
XLogP31.2
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass476.13186158
Monoisotopic Mass476.13186158
Topological Polar Surface Area164 Ų
Heavy Atom Count34
Formal Charge0
Complexity736
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3614141-01Linaroside

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