Products for Research Use Only
RegisterLogin

Zeylanan

CAT: 0013-GTR19192209Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19192209Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Zeylanan
CAS Number
20149-41-1
Smiles
CC (=O) OC1CCC23OC2C (OC3=O) c2c (C) coc2C=C1C |w:20.22|
Molecular Formula
C17H18O6
Molecular Weight
318.325
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Zeylanan

Zeylanane has been reported in Neolitsea aciculata with data available.

CAS Number20149-41-1
PubChem CID6442193
IUPAC Name[(5E)-5,10-dimethyl-15-oxo-8,14,16-trioxatetracyclo[10.2.2.01,13.07,11]hexadeca-5,7(11),9-trien-4-yl] acetate
Molecular FormulaC17H18O6
Molecular Weight318.32
XLogP1.4
Topological Polar Surface Area78.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity584
SMILES
C/C/1=C\C2=C(C3C4C(O4)(CCC1OC(=O)C)C(=O)O3)C(=CO2)C
InChI
InChI=1S/C17H18O6/c1-8-6-12-13(9(2)7-20-12)14-15-17(23-15,16(19)22-14)5-4-11(8)21-10(3)18/h6-7,11,14-15H,4-5H2,1-3H3/b8-6+
InChIKey
ZJPVGXJXVIUSQM-SOFGYWHQSA-N
Chemical Structure
2D Structure
2D structure of Zeylanan
CAS: 20149-41-1
CID: 6442193
Formula: C17H18O6
MW: 318.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.32
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass318.11033829
Monoisotopic Mass318.11033829
Topological Polar Surface Area78.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity584
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19221785-01Zeylanine

Alternative Products

CatalogName
T35305Zeylanan

Popular Products