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Decuroside V

CAT: 0013-GTR19221962-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19221962-01Size:1 mg
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Description
Decuroside V is a natural coumarin glycoside isolated from the medicinal plant Notopterygium incisum. Research indicates it exhibits anti-inflammatory and neuroprotective activities in vitro, making it a compound of interest for pharmacological studies.
CAS Number
96648-59-8
Smiles
O[C@@H]1C=2C (O[C@H]1C (O[C@@H]3O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]3O) (C) C) =CC4=C (C2) C=CC (=O) O4
Molecular Formula
C20H24O10
Molecular Weight
424.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Decuroside V

Decuroside V has been reported in Halosciastrum melanotilingia and Angelica decursiva with data available.

CAS Number96648-59-8
PubChem CID10025355
IUPAC Name(2R,3R)-3-hydroxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one
Molecular FormulaC20H24O10
Molecular Weight424.4
XLogP-0.8
Topological Polar Surface Area155
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity680
SMILES
CC(C)([C@H]1[C@@H](C2=C(O1)C=C3C(=C2)C=CC(=O)O3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI
InChI=1S/C20H24O10/c1-20(2,30-19-17(26)16(25)15(24)12(7-21)29-19)18-14(23)9-5-8-3-4-13(22)27-10(8)6-11(9)28-18/h3-6,12,14-19,21,23-26H,7H2,1-2H3/t12-,14-,15-,16+,17-,18-,19+/m1/s1
InChIKey
KLPNFWKZLQAVTH-CWMWYVAESA-N
Chemical Structure
2D Structure
2D structure of Decuroside V
CAS: 96648-59-8
CID: 10025355
Formula: C20H24O10
MW: 424.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight424.4
XLogP3-0.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass424.13694696
Monoisotopic Mass424.13694696
Topological Polar Surface Area155 Ų
Heavy Atom Count30
Formal Charge0
Complexity680
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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