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Ascolactone

CAT: 0498-bs-75743C-01Size: 500 µgDry Ice: NoHazardous: No
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CAT#:0498-bs-75743C-01Size:500 µg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
757995-43-0
Conjugation
Unconjugated
Purity
>98% (HPLC)
Buffer
Solid
Solubility
Soluble in methylene chloride or DMSO.
Smiles
CCCCCCCCCCC[C@H]1C[C@@H](O)[C@H](O)C(=O)O1
Molecular Formula
C16H30O4
Molecular Weight
286.4
Storage Conditions
Stable for 1 year after receipt when stored at -20°C. After reconstitution protect from light at -20°C.
Appearance
Off-white solid.

Chemical Information

(3S,4R)-dihydroxy-(6S)-undecyl-alpha-pyranone

(3S,4R)-dihydroxy-(6S)-undecyl-alpha-pyranone is a delta-lactone.

CAS Number757995-43-0
PubChem CID11380635
IUPAC Name(3S,4R,6S)-3,4-dihydroxy-6-undecyloxan-2-one
Molecular FormulaC16H30O4
Molecular Weight286.41
XLogP4.7
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count20
Formal Charge0
Complexity267
SMILES
CCCCCCCCCCC[C@H]1C[C@H]([C@@H](C(=O)O1)O)O
InChI
InChI=1S/C16H30O4/c1-2-3-4-5-6-7-8-9-10-11-13-12-14(17)15(18)16(19)20-13/h13-15,17-18H,2-12H2,1H3/t13-,14+,15-/m0/s1
InChIKey
XICNXZCTTYOLCW-ZNMIVQPWSA-N
Chemical Structure
2D Structure
2D structure of (3S,4R)-dihydroxy-(6S)-undecyl-alpha-pyranone
CAS: 757995-43-0
CID: 11380635
Formula: C16H30O4
MW: 286.41
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.41
XLogP34.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass286.21440943
Monoisotopic Mass286.21440943
Topological Polar Surface Area66.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity267
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
441817-01Ascolactone
207065-01Ascolactone ((3S,4R,6S) -3,4-Dihydroxy-6-undecyltetrahydro-2H-pyran-2-one)

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