CHEBI:84146 - 3β-hydroxycholest-5-en-26-oate

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ChEBI Name 3β-hydroxycholest-5-en-26-oate ChEBI ID CHEBI:84146 ChEBI ASCII Name 3beta-hydroxycholest-5-en-26-oate Definition A steroid acid anion that is the conjugate base of 3β-hydroxycholest-5-en-26-oic acid, obtained by deprotonation of the carboxy group; 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 C27H43O3 Net Charge -1 Average Mass 415.62910 Monoisotopic Mass 415.32177 InChI InChI=1S/C27H44O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h8,17-18,20-24,28H,5-7,9-16H2,1-4H3,(H,29,30)/p-1/t17-,18?,20+,21+,22-,23+,24+,26+,27-/m1/s1 InChIKey WVXOMPRLWLXFAP-AMQKJUDNSA-M SMILES C[C@H](CCCC(C)C([O-])=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C ChEBI Ontology Outgoing 3β-hydroxycholest-5-en-26-oate (CHEBI:84146) is a steroid acid anion (CHEBI:50160) 3β-hydroxycholest-5-en-26-oate (CHEBI:84146) is conjugate base of 3β-hydroxycholest-5-en-26-oic acid (CHEBI:81014) Incoming (25R)-3β-hydroxycholest-5-en-26-oate (CHEBI:86098) is a 3β-hydroxycholest-5-en-26-oate (CHEBI:84146) (25S)-cholestenoate (CHEBI:71567) is a 3β-hydroxycholest-5-en-26-oate (CHEBI:84146) 3β-hydroxycholest-5-en-26-oic acid (CHEBI:81014) is conjugate acid of 3β-hydroxycholest-5-en-26-oate (CHEBI:84146) IUPAC Name (3β)-hydroxycholest-5-en-26-oate Synonym Source (3β)-hydroxy-cholest-5-en-26-oate UniProt Citation Type Source 20843794 PubMed citation SUBMITTER Last Modified 12 August 2021