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Verbasoside

CAT: 1410-M29351-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:1410-M29351-01Size:2 mg
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Description
Verbasoside is a phenylpropanoid isolated from the roots of Rehmannia glutinosa (Gaertn.) DC.
CAS Number
61548-34-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
462.5
Molecular Formula
C20H30O12
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Decaffeoylverbascoside

Verbasoside is a glycoside.

CAS Number61548-34-3
PubChem CID11754080
IUPAC Name(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol
Molecular FormulaC20H30O12
Molecular Weight462.4
XLogP-1.9
Topological Polar Surface Area199
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity581
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2O)OCCC3=CC(=C(C=C3)O)O)CO)O)O)O)O
InChI
InChI=1S/C20H30O12/c1-8-13(24)15(26)16(27)20(30-8)32-18-14(25)12(7-21)31-19(17(18)28)29-5-4-9-2-3-10(22)11(23)6-9/h2-3,6,8,12-28H,4-5,7H2,1H3/t8-,12+,13-,14+,15+,16+,17+,18-,19+,20-/m0/s1
InChIKey
DORPKYRPJIIARM-GYAWPQPFSA-N
Chemical Structure
2D Structure
2D structure of Decaffeoylverbascoside
CAS: 61548-34-3
CID: 11754080
Formula: C20H30O12
MW: 462.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight462.4
XLogP3-1.9
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Exact Mass462.17372639
Monoisotopic Mass462.17372639
Topological Polar Surface Area199 Ų
Heavy Atom Count32
Formal Charge0
Complexity581
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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