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Oleoyl Serinate (HCID 86669080)|Huagongshe
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Compound
Oleoyl Serinate
HCID
86669080
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC(=O)[C@@H](N)CO
InChIKey
BFEYXGBQUBHTBA-VJIACCKLSA-N
Molecular formula
C21H39NO4
Average molar mass
369.5 g/mol
Monoisotopic mass
369.28790873
Names & identifiers
Preferred name
Oleoyl Serinate
IUPAC
[(2S)-2-amino-3-hydroxypropanoyl] (Z)-octadec-9-enoate
Names & synonyms
Oleoyl Serinate
SCHEMBL31139721
BFEYXGBQUBHTBA-VJIACCKLSA-N
Database identifiers
PubChem CID
86669080
Properties
Computed structural properties
XLogP
5.8
Topological polar surface area
89.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
19
Heavy atoms
26
Formal charge
0
Complexity
382
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Related reactions
1 records
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As product
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As solvent
HRID
707632
As product
uspto-grants-2015_11
Compound notes
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