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13-hydroperoxy-(9Z,11E,15Z)-octadecatrienoate

PropertiesImage
MNX_IDMNXM1106900 Image of MNXM1106900
referencechebi:144034
formulaC18H29O4
global charge-1
mol weight309.426
InChIKeyUYQGVDXDXBAABN-JDTPQGGVSA-M
InChIInChI=1S/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h3,7,9,11-12,15,17,21H,2,4-6,8,10,13-14,16H2,1H3,(H,19,20)/p-1/b9-7-,11-3-,15-12+
SMILESCC/C=C\CC(/C=C/C=C\CCCCCCCC(=O)[O-])OO
MNX internals
InChI (mnx)InChI=1/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h3,7,9,11-12,15,17,21H,2,4-6,8,10,13-14,16H2,1H3,(H,19,20)/b9-7-,11-3-,15-12+/t17? Image of MNXM1106900
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:11]\[CH2:14][CH:17](/[CH:15]=[CH:12]/[CH:9]=[CH:7]\[CH2:5][CH2:4][CH2:6][CH2:8][CH2:10][CH2:13][CH2:16][C:18](=[O:19])[OH:20])[O:22][OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:144034
chebi:144034
UYQGVDXDXBAABN-JDTPQGGVSA-M 		13-hydroperoxy-(9Z,11E,15Z)-octadecatrienoate
(9Z,11E,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate
(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoate

CHEBI:145300
chebi:145300
UYQGVDXDXBAABN-JDTPQGGVSA-N 		(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid
(9Z,11E,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid
13-HpOTrE

sabiork.compound:24770
sabiorkM:24770
UYQGVDXDXBAABN-JDTPQGGVSA-M 		Hydroperoxylinolenic acid