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Chemical structure of 11-trans Leukotriene C4

GC41144

11-trans Leukotriene C4

Also known as (5S,6R,7E,9E,11E,14Z)-6-[(2R)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid

11-trans Leukotriene C4 (11-trans LTC4) is a C-11 double bond isomer of LTC4

ChemicalCAS74841-69-3MW625.8FormulaC30H47N3O9S
CAS number
74841-69-3
Molecular weight
625.8
Formula
C30H47N3O9S
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
GWNVDXQDILPJIG-CCHJCNDSSA-N
Catalogue number
GC41144
Brand
GLPBIO
Computed properties PubChem CID 5283134 · XLogP 0.7 · TPSA 242 Ų · H-bond donors 7
XLogP
0.7
TPSA
242 Ų
H-bond donors
7
H-bond acceptors
11
Rotatable bonds
25
Heavy atoms
43

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)NC(=O)CC[C@@H](C(=O)O)N

Computed descriptors from PubChem (CID 5283134), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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