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(±) -α-Bisabolol

CAT: 0931-T8199-01Size: 1 mLDry Ice: NoHazardous: No
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CAT#:0931-T8199-01Size:1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
515-69-5
Target
PI3K, Antioxidant, Apoptosis
Related Pathways
PI3K/Akt/mTOR signaling, Oxidation-Reduction, Apoptosis
Purity
0.9944
Bioactivity
(±) -α-Bisabolol (Bisabolol) isa sesquiterpenol extracted from essential oils of chamomile, candida and other plants. It isa natural antiseptic with soothing, antiirritating, anti-inflammatory, antioxidant and anticancer activities. (±) -α-Bisabolol has anticancer effects on A549 NSC-LC cells by inducing cell cycle arrest, mitochondrial death and inhibiting PI3K/Akt signaling (IC50 = 15 μM) . (±) -α-Bisabolol can induce apoptosis of glioma cells.
Smiles
CC(C)=CCCC(C)(O)C1CCC(C)=CC1
Molecular Formula
C15H26O
Molecular Weight
222.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bisabolol

(+)-alpha-Bisabolol is a sesquiterpenoid.

CAS Number515-69-5
PubChem CID1549992
IUPAC Name(2R)-6-methyl-2-[(1R)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol
Molecular FormulaC15H26O
Molecular Weight222.37
XLogP3.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity284
SMILES
CC1=CC[C@@H](CC1)[C@@](C)(CCC=C(C)C)O
InChI
InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15+/m0/s1
InChIKey
RGZSQWQPBWRIAQ-LSDHHAIUSA-N
Chemical Structure
2D Structure
2D structure of Bisabolol
CAS: 515-69-5
CID: 1549992
Formula: C15H26O
MW: 222.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight222.37
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass222.198365449
Monoisotopic Mass222.198365449
Topological Polar Surface Area20.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity284
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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FB40402-01A-Bisabolol
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