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Leukotriene E4

CAT: 1106-BML-LE004-1000Size: 1 mgDry Ice: YesHazardous: No
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CAT#:1106-BML-LE004-1000Size:1 mg
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CAS Number
75715-89-8
Product Name Alternative
LTE4
Certification
RUO
Target
Leukotriene receptor, Prostanoid receptor
Type
Ligand
Stability
As indicated on product label or CoA when stored as recommended. Store, as supplied, at -80°C for up to 1 year.
Purity
≥98% (HPLC)
Molecular Formula
C 23 H 37 NO 5 S
Molecular Weight
439.6
Shipping Conditions
Dry Ice
Storage Conditions
-80°C
Appearance
Liquid.
Formulation
Solution in ethanol.

Chemical Information

Leukotriene E4

Leukotriene E4 is a leukotriene that is (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid substituted by a hydroxy group at position 5 (5S) and an L-cystein-S-yl group at position 6 (6R). It is a leukotriene, a L-cysteine thioether, a secondary alcohol, an amino dicarboxylic acid and a non-proteinogenic L-alpha-amino acid. It is functionally related to an icosa-7,9,11,14-tetraenoic acid. It is a conjugate acid of a leukotriene E4(1-).

CAS Number75715-89-8
PubChem CID5280879
IUPAC Name(5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-amino-2-carboxyethyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid
Molecular FormulaC23H37NO5S
Molecular Weight439.6
XLogP2.1
Topological Polar Surface Area146
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Heavy Atom Count30
Formal Charge0
Complexity586
SMILES
CCCCC/C=C\C/C=C\C=C\C=C\[C@H]([C@H](CCCC(=O)O)O)SC[C@@H](C(=O)O)N
InChI
InChI=1S/C23H37NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(30-18-19(24)23(28)29)20(25)15-14-17-22(26)27/h6-7,9-13,16,19-21,25H,2-5,8,14-15,17-18,24H2,1H3,(H,26,27)(H,28,29)/b7-6-,10-9-,12-11+,16-13+/t19-,20-,21+/m0/s1
InChIKey
OTZRAYGBFWZKMX-FRFVZSDQSA-N
Chemical Structure
2D Structure
2D structure of Leukotriene E4
CAS: 75715-89-8
CID: 5280879
Formula: C23H37NO5S
MW: 439.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight439.6
XLogP32.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Exact Mass439.23924445
Monoisotopic Mass439.23924445
Topological Polar Surface Area146 Ų
Heavy Atom Count30
Formal Charge0
Complexity586
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count4
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes