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Neodiosmin

CAT: 1410-M18505-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M18505-02Size:1 mL x 10 mM in DMSO
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Description
Neodiosmin has poor aqueous solubility but exerts a good debittering effect and is a strong antioxidant with potential applications in foods, beverages, and pharmaceutical preparations.
CAS Number
38665-01-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
608.54
Molecular Formula
C28H32O15
Notes
Research use only, not for human use.
Receptor
Antioxidant

Chemical Information

Neodiosmin

Neodiosmin has been reported in Citrus paradisi and Citrus maxima with data available.

CAS Number38665-01-9
PubChem CID69964214
IUPAC Name7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one
Molecular FormulaC28H32O15
Molecular Weight608.5
XLogP-0.3
Topological Polar Surface Area234
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Heavy Atom Count43
Formal Charge0
Complexity995
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O
InChI
InChI=1S/C28H32O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-8,10,19,21-31,33-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1
InChIKey
VCCNKWWXYVWTLT-CYZBKYQRSA-N
Chemical Structure
2D Structure
2D structure of Neodiosmin
CAS: 38665-01-9
CID: 69964214
Formula: C28H32O15
MW: 608.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight608.5
XLogP3-0.3
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Exact Mass608.17412031
Monoisotopic Mass608.17412031
Topological Polar Surface Area234 Ų
Heavy Atom Count43
Formal Charge0
Complexity995
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

Alternative Products

CatalogName
AB0991Neodiosmin
HY-N4122RNeodiosmin (Standard)
371720Neodiosmin discontinued
sc-478022Neodiosmin-d3

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