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Liriodendrin

CAT: 0013-GTR19183352-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19183352-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Liriodendrin is a bioactive small molecule that modulates lung inflammation by inhibiting NF-κB (p65) phosphorylation and VEGF expression. It exhibits anti-inflammatory, antinociceptive, and hypoglycemic properties, with demonstrated protective effects in sepsis models, making it relevant for research in immunology and metabolic disease.
CAS Number
573-44-4
Field of Research
Immunology & Inflammation, Metabolism Research, Pharmacology & Drug Discovery, Signal Transduction
Purity
97.47% (May vary between batches)
Smiles
COc1cc ([C@H]2OC[C@@H]3[C@@H] (c (cc4OC) cc (OC) c4O[C@@H] ([C@@H] ([C@H]4O) O) O[C@H] (CO) [C@H]4O) OC[C@@H]23) cc (OC) c1O[C@@H] ([C@@H] ([C@H]1O) O) O[C@H] (CO) [C@H]1O
Molecular Formula
C34H46O18
Molecular Weight
742.72
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Liriodendrin

liriodendrin has been reported in Plumeria rubra, Iodes cirrhosa, and other organisms with data available.

CAS Number573-44-4
PubChem CID21603207
IUPAC Name(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-6-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC34H46O18
Molecular Weight742.7
XLogP-1.4
Topological Polar Surface Area254
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Heavy Atom Count52
Formal Charge0
Complexity1010
SMILES
COC1=CC(=CC(=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC)[C@@H]3[C@H]4CO[C@@H]([C@H]4CO3)C5=CC(=C(C(=C5)OC)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)OC
InChI
InChI=1S/C34H46O18/c1-43-17-5-13(6-18(44-2)31(17)51-33-27(41)25(39)23(37)21(9-35)49-33)29-15-11-48-30(16(15)12-47-29)14-7-19(45-3)32(20(8-14)46-4)52-34-28(42)26(40)24(38)22(10-36)50-34/h5-8,15-16,21-30,33-42H,9-12H2,1-4H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,33-,34-/m0/s1
InChIKey
FFDULTAFAQRACT-XKBSQSBASA-N
Chemical Structure
2D Structure
2D structure of Liriodendrin
CAS: 573-44-4
CID: 21603207
Formula: C34H46O18
MW: 742.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight742.7
XLogP3-1.4
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Exact Mass742.26841461
Monoisotopic Mass742.26841461
Topological Polar Surface Area254 Ų
Heavy Atom Count52
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count14
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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