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Fumagillol

CAT: 0607-BA1296-5.1Size: 1 mL (10 mM in DMSO)Dry Ice: NoHazardous: No
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CAT#:0607-BA1296-5.1Size:1 mL (10 mM in DMSO)
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CAS Number
108102-51-8
Form
A solid
Molecular Formula
C16H26O4
Molecular Weight
282.38
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Fumagillol

Fumagillol is a sesquiterpenoid with antimicrobial properties. It has a role as an antimicrobial agent. It is a spiro-epoxide, a sesquiterpenoid and a secondary alcohol.

CAS Number108102-51-8
PubChem CID222778
IUPAC Name(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-ol
Molecular FormulaC16H26O4
Molecular Weight282.37
XLogP1.7
Topological Polar Surface Area54.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity417
SMILES
CC(=CC[C@@H]1[C@@](O1)(C)[C@H]2[C@@H]([C@@H](CC[C@]23CO3)O)OC)C
InChI
InChI=1S/C16H26O4/c1-10(2)5-6-12-15(3,20-12)14-13(18-4)11(17)7-8-16(14)9-19-16/h5,11-14,17H,6-9H2,1-4H3/t11-,12-,13-,14-,15+,16+/m1/s1
InChIKey
CEVCTNCUIVEQOY-JQOWZUPLSA-N
Chemical Structure
2D Structure
2D structure of Fumagillol
CAS: 108102-51-8
CID: 222778
Formula: C16H26O4
MW: 282.37
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight282.37
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass282.18310931
Monoisotopic Mass282.18310931
Topological Polar Surface Area54.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity417
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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