CHEBI:47803 - (23S)-23,25,26-trihydroxycalciol

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ChEBI Name (23S)-23,25,26-trihydroxycalciol ChEBI ID CHEBI:47803 ChEBI ASCII Name (23S)-23,25,26-trihydroxycalciol Stars This entity has been manually annotated by the ChEBI Team. Supplier Information ChemicalBook:CB8233514, eMolecules:31240789, ZINC000004521813 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H44O4 Net Charge 0 Average Mass 432.63586 Monoisotopic Mass 432.32396 InChI InChI=1S/C27H44O4/c1-18-7-10-22(29)15-21(18)9-8-20-6-5-13-27(4)24(11-12-25(20)27)19(2)14-23(30)16-26(3,31)17-28/h8-9,19,22-25,28-31H,1,5-7,10-17H2,2-4H3/b20-8+,21-9-/t19-,22+,23+,24-,25+,26?,27-/m1/s1 InChIKey GDIBDBUYVICGLY-VVFBGWIOSA-N SMILES [H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)CCC1=C)[C@H](C)C[C@H](O)CC(C)(O)CO Metabolite of Species Details Homo sapiens (NCBI:txid9606) See: DOI Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing (23S)-23,25,26-trihydroxycalciol (CHEBI:47803) has role human metabolite (CHEBI:77746) (23S)-23,25,26-trihydroxycalciol (CHEBI:47803) is a hydroxycalciol (CHEBI:47042) Incoming (23S,25R)-23,25,26-trihydroxycalciol (CHEBI:47834) is a (23S)-23,25,26-trihydroxycalciol (CHEBI:47803) IUPAC Name (3S,5Z,7E,23S)-9,10-secocholesta-5,7,10-triene-3,23,25,26-tetrol Synonyms Sources (23S)-23,25,26-trihydroxycholecalciferol IUPAC 23S,25,26(OH)3D3 ChEBI 23S,25,26-trihydroxycholecalciferol IUPAC 23S,25,26-trihydroxyvitamin D3 ChEBI Last Modified 10 March 2014