11-trans-LTE4
Basic information
- CAS
75715-88-7- Standard SMILES
CCCCC/C=C\C/C=C/C=C/C=C/[C@@H](SC[C@H](N)C(=O)O)[C@@H](O)CCCC(=O)O- InChIKey
OTZRAYGBFWZKMX-DVFCZEDWSA-N- Molecular formula
- C23H37NO5S
- Average molar mass
- 439.6 g/mol
- Monoisotopic mass
- 439.23924445
Overview
11-trans-LTE4 is a leukotriene that is the 11-trans-isomer of leukotriene E4. It has a role as a metabolite. It is functionally related to an icosa-7,9,11,14-tetraenoic acid.
Names & identifiers
- Preferred name
- 11-trans-LTE4
- IUPAC
- (5S,6R,7E,9E,11E,14Z)-6-[(2R)-2-amino-2-carboxyethyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid
- English name
- 11-TRANS LEUKOTRIENE E4
- Molecular formula
- C23H37NO5S
- Molecular weight
- 439.61
Names & synonyms
11-trans-LTE411-trans-Leukotriene E411t-LTE4CHEBI:727795S-hydroxy-6R-(S-cysteinyl)-7E,9E,11E,14Z-eicosatetraenoic acid5S-hydroxy-6R-(S-cysteinyl)-7E,9E,11E14Z-eicosatetraenoic acid(5S,6R,7E,9E,11E,14Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid(5S,6R,7E,9E,11E,14Z)-6-(((2R)-2-amino-2-carboxyethyl)sulfanyl)-5-hydroxyicosa-7,9,11,14-tetraenoic acidRefChem:7801511-trans Leukotriene E475715-88-7(5S,6R,7E,9E,11E,14Z)-6-[(2R)-2-amino-2-carboxyethyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid
Show more names
11-TRANS LTE4OTZRAYGBFWZKMX-DVFCZEDWSA-N11-trans Leukotriene E-4,11 trans Leukotriene E4,11trans Leukotriene E47,9,11,14-Eicosatetraenoic acid, 6-[[(2R)-2-amino-2-carboxyethyl]thio]-5-hydroxy-, (5S,6R,7E,9E,11E,14Z)-
11-TRANSLEUKOTRIENEE4orb1692839SCHEMBL20613745DTXSID901357764LMFA03020022AKOS040755864HY-113465ADA-59849
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 18
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 586
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Eicosanoids [FA03] -> Leukotrienes [FA0302]
Physicochemical properties
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 50 mg/ml; · DMF: 50 mg/ml; DMSO: 50 mg/ml; Ethanol: 50 mg/ml; PBS pH 7.2: 0.1 mg/ml
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H319
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P264-P280-P303+P361+P353-P305+P351+P338-P337+P313-P370+P378-P403+P235-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H225-H319
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P264-P280-P303+P361+P353-P305+P351+P338-P337+P313-P370+P378-P403+P235-P501
Chemistry & industry
Applications
DescriptionSlow isomerization of the C-11 double bond of LTE4 leads to the formation of 11-trans LTE4. 11-trans LTE4 is equipotent to LTE4 in contracting guinea pig ileum.
Uses11-trans Leukotriene E4 is an equipotent C-11 double bond isomer of LTE4.
Additional notes
DefinitionChEBI: 11-trans-LTE4 is a leukotriene that is the 11-trans-isomer of leukotriene E4. It has a role as a metabolite. It is functionally related to an icosa-7,9,11,14-tetraenoic acid.
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