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(14S)-hydroperoxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate

PropertiesImage
MNX_IDMNXM33397 Image of MNXM33397
referencechebi:78048
formulaC22H31O4
global charge-1
mol weight359.486
InChIKeyOAGAUECBCOAGOL-OUKOMXQNSA-M
InChIInChI=1S/C22H32O4/c1-2-3-4-5-12-15-18-21(26-25)19-16-13-10-8-6-7-9-11-14-17-20-22(23)24/h3-4,6-7,10-16,19,21,25H,2,5,8-9,17-18,20H2,1H3,(H,23,24)/p-1/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+/t21-/m0/s1
SMILESCC/C=C\C/C=C\C[C@@H](/C=C/C=C\C/C=C\C/C=C\CCC(=O)[O-])OO
MNX internals
InChI (mnx)InChI=1/C22H32O4/c1-2-3-4-5-12-15-18-21(26-25)19-16-13-10-8-6-7-9-11-14-17-20-22(23)24/h3-4,6-7,10-16,19,21,25H,2,5,8-9,17-18,20H2,1H3,(H,23,24)/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+/t21-/m0/s1 Image of MNXM33397
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:5]/[CH:12]=[CH:15]\[CH2:18][C@@H:21](/[CH:19]=[CH:16]/[CH:13]=[CH:10]\[CH2:8]/[CH:6]=[CH:7]\[CH2:9]/[CH:11]=[CH:14]\[CH2:17][CH2:20][C:22](=[O:23])[OH:24])[O:26][OH:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:78048
chebi:78048
OAGAUECBCOAGOL-OUKOMXQNSA-M 		(14S)-hydroperoxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate
(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoate
(4Z,7Z,10Z,12E,14S,16Z,19Z)-hydroperoxydocosahexaenoate(1-)
14(S)-HPDHE(1-)

metacyc.compound:CPD-25487
metacycM:CPD-25487
OAGAUECBCOAGOL-OUKOMXQNSA-M 		(14S)-HpDHA
(14S)-HpDHE
(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoate
(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoic acid
(4Z,7Z,10Z,12E,14S,16Z,19Z)-hydroperoxydocosahexaenoate
(4Z,7Z,10Z,12E,14S,16Z,19Z)-hydroperoxydocosahexaenoic acid

SLM:000389569
slm:000389569
OAGAUECBCOAGOL-OUKOMXQNSA-M 		(14S)-hydroperoxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate
(14S)-Hp-(4Z,7Z,10Z,12E,16Z,19Z)-DHE
(14S)-HpDHE

CHEBI:78861
chebi:78861
OAGAUECBCOAGOL-OUKOMXQNSA-N 		14(S)-HPDHE
(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoic acid
(4Z,7Z,10Z,12E,14S,16Z,19Z)-hydroperoxydocosahexaenoic acid

CHEBI:84177
chebi:84177
OAGAUECBCOAGOL-BGKMTWLOSA-N 		14-HPDHE
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoic acid
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosahexaenoic acid
14-HPD(4,7,10,12,16,19)HE

CHEBI:83336
chebi:83336
OAGAUECBCOAGOL-BGKMTWLOSA-M 		14-hydroperoxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-4,7,10,12,16,19-hexaenoate
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosahexaenoate(1-)
14-HPD(4,7,10,12,16,19)HE(1-)
14-HPDHE(1-)

SLM:000501355
slm:000501355
OAGAUECBCOAGOL-BGKMTWLOSA-M 		14-hydroperoxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate
14-HpDHE
14Hp-(4Z,7Z,10Z,12E,16Z,19Z)-DHE

lipidmaps:LMFA04000067
lipidmapsM:LMFA04000067
OAGAUECBCOAGOL-OUKOMXQNSA-N 		14S-HpDHA
14S-hydroperoxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoic acid
FA 22:6
O2