CHEBI:77310 - (E)-2-methylpentadec-2-enoyl-CoA(4−)

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ChEBI Name (E)-2-methylpentadec-2-enoyl-CoA(4−) ChEBI ID CHEBI:77310 ChEBI ASCII Name (E)-2-methylpentadec-2-enoyl-CoA(4-) Definition A monounsaturated fatty acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of (E)-2-methylpentadec-2-enoyl-CoA; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter AnneNiknejad 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 C37H60N7O17P3S Net Charge -4 Average Mass 999.89700 Monoisotopic Mass 999.30012 InChI InChI=1S/C37H64N7O17P3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-25(2)36(49)65-20-19-39-27(45)17-18-40-34(48)31(47)37(3,4)22-58-64(55,56)61-63(53,54)57-21-26-30(60-62(50,51)52)29(46)35(59-26)44-24-43-28-32(38)41-23-42-33(28)44/h16,23-24,26,29-31,35,46-47H,5-15,17-22H2,1-4H3,(H,39,45)(H,40,48)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/p-4/b25-16+/t26-,29-,30-,31+,35-/m1/s1 InChIKey WNGGEBDAVYDQDR-CKZWSVNZSA-J SMILES CCCCCCCCCCCC\C=C(/C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12 ChEBI Ontology Outgoing (E)-2-methylpentadec-2-enoyl-CoA(4−) (CHEBI:77310) is a long-chain fatty acyl-CoA(4−) (CHEBI:83139) (E)-2-methylpentadec-2-enoyl-CoA(4−) (CHEBI:77310) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331) (E)-2-methylpentadec-2-enoyl-CoA(4−) (CHEBI:77310) is conjugate base of (E)-2-methylpentadec-2-enoyl-CoA (CHEBI:87259) Incoming (E)-2-methylpentadec-2-enoyl-CoA (CHEBI:87259) is conjugate acid of (E)-2-methylpentadec-2-enoyl-CoA(4−) (CHEBI:77310) Synonyms Sources (E)-2-methylpentadec-2-enoyl-coenzyme A(4−) ChEBI 2-methyl-(2E)-pentadecenoyl-CoA UniProt Citation Type Source 8654595 PubMed citation SUBMITTER Last Modified 10 August 2015