Chem
J-GLOBAL ID：200907078847042795   Nikkaji number：J591.182F

[14,15,19,19,20,20-3H]LTE4

(5S,6R,7E,9E,11Z,14Z)-5-ヒドロキシ-6-[[(R)-2-アミノ-2-カルボキシエチル]チオ](14,15,19,19,20,20-3H6)イコサ-7,9,11,14-テトラエン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C23H31[3H]6NO5S
Molecular formula furigana： C23-H37-N-O5-S
Molecular weight： 451.660
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/i1T2,2T2,6T,7T
InChI key： OTZRAYGBFWZKMX-CUSJGCPYSA-N
SMILES： C([3H])([3H])C([3H])([3H])CCC/C(=C(/[3H])\C/C=C\C=C\C=C\[C@@H](SC[C@H](N)C(=O)O)[C@@H](O)CCCC(=O)O)/[3H]
Systematic name  (3)：
  • (5S,6R,7E,9E,11Z,14Z)-5-ヒドロキシ-6-[[(R)-2-アミノ-2-カルボキシエチル]チオ](14,15,19,19,20,20-3H6)イコサ-7,9,11,14-テトラエン酸
  • (5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-アミノ-2-カルボキシエチル]スルファニル}-5-ヒドロキシ(14,15,19,19,20,20-3H6)イコサ-7,9,11,14-テトラエン酸
  • (5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5-hydroxy(14,15,19,19,20,20-3H6)icosa-7,9,11,14-tetraenoic acid
Other name (2)：
  • [14,15,19,19,20,20-3H]LTE4
  • (5S,6R,7E,9E,11Z,14Z)-5-Hydroxy-6-[[(R)-2-amino-2-carboxyethyl]thio](14,15,19,19,20,20-3H6)icosa-7,9,11,14-tetraenoic acid
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