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English
ethyl (2S)-1-[(2R,3S)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Ethyl 1-(3-hydroxy-2,4-dimethyldodec-4-enoyl)pyrrolidine-2-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
367.272258664
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
ethyl tumonoate A
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₇NO₄
0 references
canonical SMILES
O=C(OCC)C1N(C(=O)C(C)C(O)C(=CCCCCCCC)C)CCC1
0 references
isomeric SMILES
CCCCCCCC=C(C)[C@@H](O)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)OCC
0 references
found in taxon
Oscillatoria margaritifera
1 reference
stated in
Phylogeny-guided isolation of ethyl tumonoate A from the marine cyanobacterium cf. Oscillatoria margaritifera
Identifiers
InChI
InChI=1S/C21H37NO4/c1-5-7-8-9-10-11-13-16(3)19(23)17(4)20(24)22-15-12-14-18(22)21(25)26-6-2/h13,17-19,23H,5-12,14-15H2,1-4H3/t17-,18+,19-/m1/s1
0 references
InChIKey
ATSNGULFDLCUIL-CEXWTWQISA-N
0 references
PubChem CID
162965191
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ATSNGULFDLCUIL-CEXWTWQISA-N
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