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Chemical structure of 11-trans Leukotriene D4

GC41147

11-trans Leukotriene D4

Also known as (5S,6R,7E,9E,11E,14Z)-6-[(2R)-2-amino-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid

11-trans Leukotriene D4 (11-trans LTD4) is a C-11 double bond isomer of LTD4

ChemicalCAS79768-40-4MW496.7FormulaC25H40N2O6S
CAS number
79768-40-4
Molecular weight
496.7
Formula
C25H40N2O6S
Solubility
DMF： >50 mg/ml (per Ramki Iyer),DMSO： >50 mg/ml (per Ramki Iyer),Ethanol： >50 mg/ml (per Ramki Iyer),PBS pH 7·2： >100 μ g/ml (per Ramki Iyer)
InChIKey
YEESKJGWJFYOOK-KJGJJCHRSA-N
Catalogue number
GC41147
Brand
GLPBIO
Computed properties PubChem CID 5283135 · XLogP 1.4 · TPSA 175 Ų · H-bond donors 5
XLogP
1.4
TPSA
175 Ų
H-bond donors
5
H-bond acceptors
8
Rotatable bonds
20
Heavy atoms
34

SMILES CCCCC/C=C\C/C=C/C=C/C=C/[C@H]([C@H](CCCC(=O)O)O)SC[C@@H](C(=O)NCC(=O)O)N

Computed descriptors from PubChem (CID 5283135), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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