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(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoate

PropertiesImage
MNX_IDMNXM36849 Image of MNXM36849
referencechebi:77217
formulaC36H59O2
global charge-1
mol weight523.866
InChIKeyXTVQYBHOOSVJTF-KUBAVDMBSA-M
InChIInChI=1S/C36H60O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36(37)38/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-35H2,1H3,(H,37,38)/p-1/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C36H60O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36(37)38/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-35H2,1H3,(H,37,38)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18- Image of MNXM36849
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][C:36](=[O:37])[OH:38]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77217
chebi:77217
XTVQYBHOOSVJTF-KUBAVDMBSA-M 		(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoate
(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriaconta-18,21,24,27,30,33-hexaenoate
C36:6(omega-3)(1-)
all-cis-hexatriaconta-18,21,24,27,30,33-hexaenoate

SLM:000001234
slm:000001234
XTVQYBHOOSVJTF-KUBAVDMBSA-M 		(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoate
36:6(18Z,21Z,24Z,27Z,30Z,33Z)

CHEBI:77500
chebi:77500
XTVQYBHOOSVJTF-KUBAVDMBSA-N 		(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoic acid
(18Z,21Z,24Z,27Z,30Z,33Z)-hexatriaconta-18,21,24,27,30,33-hexaenoic acid
18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoic acid
36:6(18Z,21Z,24Z,27Z,30Z,33Z)
36:6(omega3)
36:6n3
all-cis-hexatriaconta-18,21,24,27,30,33-hexaenoic acid

lipidmaps:LMFA01030843
lipidmapsM:LMFA01030843
XTVQYBHOOSVJTF-KUBAVDMBSA-N 		36:6(18Z,21Z,24Z,27Z,30Z,33Z)
18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoic acid
36:6(w3)
36:6n3
FA 36:6