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(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-eicosatrienoate

PropertiesImage
MNX_IDMNXM163041 Image of MNXM163041
referencechebi:132067
formulaC20H31O5
global charge-1
mol weight351.463
InChIKeyKTJVOVFOUDDZLQ-UDZUBBEJSA-M
InChIInChI=1S/C20H32O5/c1-2-3-8-14-18-19(24-18)15-10-7-5-4-6-9-12-17(25-23)13-11-16-20(21)22/h4,6-7,9-10,12,17-19,23H,2-3,5,8,11,13-16H2,1H3,(H,21,22)/p-1/b6-4-,10-7-,12-9+/t17-,18+,19-/m1/s1
SMILESCCCCC[C@@H]1O[C@@H]1C/C=C\C/C=C\C=C\[C@H](CCCC(=O)[O-])OO
MNX internals
InChI (mnx)InChI=1/C20H32O5/c1-2-3-8-14-18-19(24-18)15-10-7-5-4-6-9-12-17(25-23)13-11-16-20(21)22/h4,6-7,9-10,12,17-19,23H,2-3,5,8,11,13-16H2,1H3,(H,21,22)/b6-4-,10-7-,12-9+/t17-,18+,19-/m1/s1 Image of MNXM163041
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:8][CH2:14][C@H:18]1[C@@H:19]([CH2:15]/[CH:10]=[CH:7]\[CH2:5]/[CH:4]=[CH:6]\[CH:9]=[CH:12]\[C@H:17]([CH2:13][CH2:11][CH2:16][C:20](=[O:21])[OH:22])[O:25][OH:23])[O:24]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:132067
chebi:132067
KTJVOVFOUDDZLQ-UDZUBBEJSA-M 		(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-eicosatrienoate
(5S)-hydroperoxy-(14R,15S)-EET(1-)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoate
(5S,6E,8Z,11Z)-5-hydroperoxy-13-[(2R,3S)-3-pentyloxiran-2-yl]trideca-6,8,11-trienoate

SLM:000501526
slm:000501526
KTJVOVFOUDDZLQ-UDZUBBEJSA-M 		(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-eicosatrienoate
(5S)-Hp-(14R,15S)-Ep-(6E,8Z,11Z)-ETrE
(5S)-Hp-(14R,15S)-EpETrE

CHEBI:132683
chebi:132683
KTJVOVFOUDDZLQ-UDZUBBEJSA-N 		(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid
(5S)-HP-(14R,15S)-EET
(5S)-hydroperoxy-(14R,15S)-EET
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-eicosatrienoic acid
(5S,6E,8Z,11Z)-5-hydroperoxy-13-[(2R,3S)-3-pentyloxiran-2-yl]trideca-6,8,11-trienoic acid