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(Q76729938)
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English
[(2S)-1-hydroxy-3-[(Z)-tetradec-9-enoyl]oxypropan-2-yl] (Z)-docos-11-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
diglyceride
0 references
mass
620.5379754039998
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₃₉H₇₂O₅
0 references
canonical SMILES
CCCCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCC=CCCCCCCCCCC
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C\CCCC
0 references
Identifiers
InChI
InChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-39(42)44-37(35-40)36-43-38(41)33-31-29-27-25-23-14-12-10-8-6-4-2/h10,12,18-19,37,40H,3-9,11,13-17,20-36H2,1-2H3/b12-10-,19-18-/t37-/m0/s1
0 references
InChIKey
PTTLHCJUUXIGPD-FDOZKAONSA-N
0 references
PubChem CID
56936357
1 reference
matched by identifier from
InChIKey
InChIKey
PTTLHCJUUXIGPD-FDOZKAONSA-N
UniChem compound ID
49874609
1 reference
stated in
UniChem
LIPID MAPS ID
LMGL02010420
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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