CHEBI:85133 - 12-(phosphonooxy)octadecanoic acid

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ChEBI Name 12-(phosphonooxy)octadecanoic acid ChEBI ID CHEBI:85133 Definition A carboxyalkyl phosphate that is octadecanoic acid carrying a phosphonooxy substituent at position 12. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H37O6P Net Charge 0 Average Mass 380.45650 Monoisotopic Mass 380.23278 InChI InChI=1S/C18H37O6P/c1-2-3-4-11-14-17(24-25(21,22)23)15-12-9-7-5-6-8-10-13-16-18(19)20/h17H,2-16H2,1H3,(H,19,20)(H2,21,22,23) InChIKey QZULXZYUVCCXJM-UHFFFAOYSA-N SMILES CCCCCCC(CCCCCCCCCCC(O)=O)OP(O)(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 12-(phosphonooxy)octadecanoic acid (CHEBI:85133) has functional parent octadecanoic acid (CHEBI:28842) 12-(phosphonooxy)octadecanoic acid (CHEBI:85133) is a carboxyalkyl phosphate (CHEBI:36952) 12-(phosphonooxy)octadecanoic acid (CHEBI:85133) is conjugate acid of 12-(phosphonooxy)octadecanoate(3−) (CHEBI:85134) Incoming 12-(phosphonooxy)octadecanoate(3−) (CHEBI:85134) is conjugate base of 12-(phosphonooxy)octadecanoic acid (CHEBI:85133) IUPAC Name 12-(phosphonooxy)octadecanoic acid Synonym Source 12-(phosphonooxy)stearic acid SUBMITTER Last Modified 01 May 2015