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15(S)-HETrE

PropertiesImage
MNX_IDMNXM33401 Image of MNXM33401
referencechebi:88348
formulaC20H34O3
global charge0
mol weight322.489
InChIKeyIUKXMNDGTWTNTP-OAHXIXLCSA-N
InChIInChI=1S/C20H34O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h4-5,9,11,14,17,19,21H,2-3,6-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,11-9-,17-14+/t19-/m0/s1
SMILESCCCCC[C@H](O)/C=C/C=C\C/C=C\CCCCCCC(=O)O
MNX internals
InChI (mnx)InChI=1/C20H34O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h4-5,9,11,14,17,19,21H,2-3,6-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,11-9-,17-14+/t19-/m0/s1 Image of MNXM33401
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:13][CH2:16][C@@H:19](/[CH:17]=[CH:14]/[CH:11]=[CH:9]\[CH2:7]/[CH:5]=[CH:4]\[CH2:6][CH2:8][CH2:10][CH2:12][CH2:15][CH2:18][C:20](=[O:22])[OH:23])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:88348
chebi:88348
IUKXMNDGTWTNTP-OAHXIXLCSA-N 		15(S)-HETrE
(8Z,11Z,13E,15S)-15-hydroxyicosa-8,11,13-trienoic acid
(8Z,11Z,13E,15S)-15-hydroxyicosatrienoic acid
15-HETrE
15-Hydroxy-(8Z,11Z,13E)-eicosatrienoic acid
15-Hydroxy-cis,cis,trans-8,11,13-eicosatrienoic acid
15-Hydroxyeicosatrienoic acid
15S-HETrE
15S-Hydroxy-8Z,11Z,13E-eicosatrienoic acid

metacyc.compound:CPD-24644
metacycM:CPD-24644
IUKXMNDGTWTNTP-OAHXIXLCSA-M 		15(S)-HETrE
(8Z,11Z,13E,15S)-15-hydroxyicosa-8,11,13-trienoate
(8Z,11Z,13E,15S)-15-hydroxyicosatrienoate
15-hydroxy-(8Z,11Z,13E)-eicosatrienoate
15-hydroxy-cis,cis,trans-8,11,13-eicosatrienoate
15-hydroxyeicosatrienoate
15S-Hydroxy-8Z,11Z,13E-eicosatrienoiate
hmdb:HMDB0005045
IUKXMNDGTWTNTP-OAHXIXLCSA-N 		15(S)-Hydroxyeicosatrienoic acid
(8Z,11Z,13E,15S)-15-Hydroxyicosatrienoate
(8Z,11Z,13E,15S)-15-Hydroxyicosatrienoic acid
(8Z,11Z,13E,15S)-15-hydroxyicosa-8,11,13-trienoic acid
15(S)-Hydroxyeicosatrienoate
15-HETrE
15-Hydroxy-(8Z,11Z,13E)-eicosatrienoate
15-Hydroxy-(8Z,11Z,13E)-eicosatrienoic acid
15-Hydroxy-cis,cis,trans-8,11,13-eicosatrienoate
15-Hydroxy-cis,cis,trans-8,11,13-eicosatrienoic acid
15-Hydroxyeicosatrienoate
15-Hydroxyeicosatrienoic acid
15S-HETrE
15S-Hydroxy-8Z,11Z,13E-eicosatrienoate
15S-Hydroxy-8Z,11Z,13E-eicosatrienoic acid
6-deoxy-L-sorbose

vmhM:CE2537
vmhmetabolite:CE2537
IUKXMNDGTWTNTP-OAHXIXLCSA-N 		15(S)-Hydroxyeicosatrienoic acid
(8Z,11Z,13E,15S)-15-hydroxyicosa-8,11,13-trienoic acid

bigg.metabolite:CE2537
biggM:CE2537
IUKXMNDGTWTNTP-OAHXIXLCSA-N 		15-hydroxy-(8Z,11Z,13E)-eicosatrienoate

lipidmaps:LMFA03050007
lipidmapsM:LMFA03050007
IUKXMNDGTWTNTP-OAHXIXLCSA-N 		15S-HETrE
15S-hydroxy-8Z,11Z,13E-eicosatrienoic acid
FA 20:3
O

hmdb:HMDB05045
biggM:M_CE2537
vmhM:M_CE2537 		secondary/obsolete/fantasy identifier