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(12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoate

PropertiesImage
MNX_IDMNXM36831 Image of MNXM36831
referencechebi:77211
formulaC30H47O2
global charge-1
mol weight439.704
InChIKeyBKFMERKCQDCYIE-KUBAVDMBSA-M
InChIInChI=1S/C30H48O2/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/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-29H2,1H3,(H,31,32)/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\CCCCCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C30H48O2/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/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-29H2,1H3,(H,31,32)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18- Image of MNXM36831
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][C:30](=[O:31])[OH:32]
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:77211
chebi:77211
BKFMERKCQDCYIE-KUBAVDMBSA-M 		(12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoate
(12Z,15Z,18Z,21Z,24Z,27Z)-triaconta-12,15,18,21,24,27-hexaenoate
C30:6(omega-3)(1-)
all-cis-triaconta-12,15,18,21,24,27-hexaenoate

SLM:000001225
slm:000001225
BKFMERKCQDCYIE-KUBAVDMBSA-M 		(12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoate
30:6(12Z,15Z,18Z,21Z,24Z,27Z)

CHEBI:77377
chebi:77377
BKFMERKCQDCYIE-KUBAVDMBSA-N 		(12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoic acid
(12Z,15Z,18Z,21Z,24Z,27Z)-triaconta-12,15,18,21,24,27-hexaenoic acid
12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoic acid
30:6(12Z,15Z,18Z,21Z,24Z,27Z)
30:6(omega3)
30:6n3
all-cis-triaconta-12,15,18,21,24,27-hexaenoic acid

lipidmaps:LMFA01030840
lipidmapsM:LMFA01030840
BKFMERKCQDCYIE-KUBAVDMBSA-N 		30:6(12Z,15Z,18Z,21Z,24Z,27Z)
12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoic acid
30:6(w3)
30:6n3
FA 30:6