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(Q76512744)
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Phytyl dodecanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
478.474981224
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₃₂H₆₂O₂
0 references
canonical SMILES
CCCCCCCCCCCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCCCCCCCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C
0 references
Identifiers
InChI
InChI=1S/C32H62O2/c1-7-8-9-10-11-12-13-14-15-25-32(33)34-27-26-31(6)24-18-23-30(5)22-17-21-29(4)20-16-19-28(2)3/h26,28-30H,7-25,27H2,1-6H3/b31-26+/t29-,30-/m1/s1
0 references
InChIKey
AGWFXWWNJHQGIB-KONNFPMYSA-N
0 references
PubChem CID
24837746
0 references
ChEBI ID
177027
0 references
UniChem compound ID
65335981
1 reference
stated in
UniChem
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