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Neosolaniol

CAT: 0931-T16285-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T16285-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
36519-25-2
Target
Potassium Channel
Related Pathways
Membrane transporter/Ion channel
Bioactivity
Neosolaniol, a type A trichothecene mycotoxin produced by Fusarium species, strongly induces an anorectic (loss of appetite) response.
Smiles
CC(=O)OCC12CC(O)C(C)=CC1OC1C(O)C(OC(C)=O)C2(C)C11CO1
Molecular Formula
C19H26O8
Molecular Weight
382.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Neosolaniol

neosolaniol has been reported in Fusarium and Fusarium sporotrichioides with data available.

CAS Number36519-25-2
PubChem CID13818797
IUPAC Name[(1S,2R,4S,7R,9R,10R,11S,12S)-11-acetyloxy-4,10-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methyl acetate
Molecular FormulaC19H26O8
Molecular Weight382.4
XLogP-0.9
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity718
SMILES
CC1=C[C@@H]2[C@](C[C@@H]1O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)COC(=O)C
InChI
InChI=1S/C19H26O8/c1-9-5-13-18(6-12(9)22,7-24-10(2)20)17(4)15(26-11(3)21)14(23)16(27-13)19(17)8-25-19/h5,12-16,22-23H,6-8H2,1-4H3/t12-,13+,14+,15+,16+,17+,18+,19-/m0/s1
InChIKey
TVZHDVCTOCZDNE-WVJYZQHISA-N
Chemical Structure
2D Structure
2D structure of Neosolaniol
CAS: 36519-25-2
CID: 13818797
Formula: C19H26O8
MW: 382.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.4
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass382.16276778
Monoisotopic Mass382.16276778
Topological Polar Surface Area115 Ų
Heavy Atom Count27
Formal Charge0
Complexity718
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N6799-01Neosolaniol
HY-N6799RNeosolaniol (Standard)
MSS1018-01Pribolab® Neosolaniol
BIN1002-01Neosolaniol from Fusaruim sp.
STD#3171-01Pribolab® Neosolaniol (100 µg/mL) in Acetonitrile

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