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Bidenoside C

CAT: 0931-TN6594-02Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN6594-02Size:1 mg
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CAS Number
700877-55-0
Target
Others
Related Pathways
Others
Purity
0.9878
Bioactivity
Bidenoside C is a flavonoid found in brazilian propolis, the first of its kind to be isolated from a herb of the genus Leech, and has anti-proliferative activity against cancer cells.
Smiles
O(CCCC#CC#C/C=C\C)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Molecular Formula
C16H22O6
Molecular Weight
310.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bidenoside C

See also: Bidenoside C (annotation moved to).

CAS Number700877-55-0
PubChem CID21577069
IUPAC Name(2R,3R,4S,5S,6R)-2-[(Z)-dec-8-en-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC16H22O6
Molecular Weight310.34
XLogP0.4
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity488
SMILES
C/C=C\C#CC#CCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C16H22O6/c1-2-3-4-5-6-7-8-9-10-21-16-15(20)14(19)13(18)12(11-17)22-16/h2-3,12-20H,8-11H2,1H3/b3-2-/t12-,13-,14+,15-,16-/m1/s1
InChIKey
QIFYDSMWESCVBZ-JNDSXIQISA-N
Chemical Structure
2D Structure
2D structure of Bidenoside C
CAS: 700877-55-0
CID: 21577069
Formula: C16H22O6
MW: 310.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight310.34
XLogP30.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass310.14163842
Monoisotopic Mass310.14163842
Topological Polar Surface Area99.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity488
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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