CHEBI:87700 - (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA(4−)

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ChEBI Name (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA(4−) ChEBI ID CHEBI:87700 ChEBI ASCII Name (24E)-3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl-CoA(4-) Definition An acyl-CoA(4−) arising from deprotonation of phosphate and diphosphate OH groups of (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA; major species at pH 7.3. 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 C48H74N7O19P3S Net Charge -4 Average Mass 1178.126 Monoisotopic Mass 1177.39950 InChI InChI=1S/C48H78N7O19P3S/c1-26(30-10-11-31-36-32(13-16-48(30,31)6)47(5)15-12-29(56)20-28(47)21-33(36)57)8-7-9-27(2)45(62)78-19-18-50-35(58)14-17-51-43(61)40(60)46(3,4)23-71-77(68,69)74-76(66,67)70-22-34-39(73-75(63,64)65)38(59)44(72-34)55-25-54-37-41(49)52-24-53-42(37)55/h9,24-26,28-34,36,38-40,44,56-57,59-60H,7-8,10-23H2,1-6H3,(H,50,58)(H,51,61)(H,66,67)(H,68,69)(H2,49,52,53)(H2,63,64,65)/p-4/b27-9+/t26-,28+,29-,30-,31+,32+,33-,34-,36+,38-,39-,40+,44-,47+,48-/m1/s1 InChIKey SEBZZAWTQNNGPK-RDYMGNODSA-J SMILES [C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC(C)([C@H](C(NCCC(NCCSC(=O)/C(/C)=C/CC[C@]([C@@]4([C@]5(CC[C@@]6([C@]7(CC[C@H](C[C@]7(C[C@H]([C@]6([C@@]5(CC4)[H])[H])O)[H])O)C)[H])C)[H])(C)[H])=O)=O)O)C)(=O)[O-])(=O)[O-])[C@H]([C@H]1O)OP([O-])([O-])=O ChEBI Ontology Outgoing (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA(4−) (CHEBI:87700) is a steroidal acyl-CoA(4−) (CHEBI:131622) (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA(4−) (CHEBI:87700) is conjugate base of (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA (CHEBI:88064) Incoming (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA (CHEBI:88064) is conjugate acid of (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA(4−) (CHEBI:87700) Synonyms Sources (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-CoA UniProt (24E)-3α,7α-dihydroxy-5β-cholest-24-en-26-oyl-coenzyme A(4−) ChEBI Citation Type Source 11146090 PubMed citation SUBMITTER Last Modified 19 May 2016