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Ginsenoyne K

CAT: 0013-GTR19228058-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19228058-01Size:1 mg
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Description
Ginsenoyne K is a bioactive small molecule utilized in life science research. It serves as a valuable tool compound for investigating biological mechanisms in both in vitro cellular assays and in vivo pharmacological studies.
CAS Number
141947-42-4
Smiles
[C@@H] (/C=C/C#CC#C[C@@H] (C=C) O) (CCCCCCC) OO
Molecular Formula
C17H24O3
Molecular Weight
276.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(3R,8E,10S)-10-Hydroperoxyheptadeca-1,8-dien-4,6-diyn-3-OL

(3R,8E,10S)-10-Hydroperoxyheptadeca-1,8-dien-4,6-diyn-3-OL has been reported in Panax ginseng with data available.

CAS Number141947-42-4
PubChem CID91884950
IUPAC Name(3R,8E,10S)-10-hydroperoxyheptadeca-1,8-dien-4,6-diyn-3-ol
Molecular FormulaC17H24O3
Molecular Weight276.4
XLogP4.3
Topological Polar Surface Area49.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count20
Formal Charge0
Complexity410
SMILES
CCCCCCC[C@@H](/C=C/C#CC#C[C@@H](C=C)O)OO
InChI
InChI=1S/C17H24O3/c1-3-5-6-7-11-14-17(20-19)15-12-9-8-10-13-16(18)4-2/h4,12,15-19H,2-3,5-7,11,14H2,1H3/b15-12+/t16-,17+/m1/s1
InChIKey
SYNBBWLEYQBFQT-ODQHEUEKSA-N
Chemical Structure
2D Structure
2D structure of (3R,8E,10S)-10-Hydroperoxyheptadeca-1,8-dien-4,6-diyn-3-OL
CAS: 141947-42-4
CID: 91884950
Formula: C17H24O3
MW: 276.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight276.4
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass276.17254462
Monoisotopic Mass276.17254462
Topological Polar Surface Area49.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity410
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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