CHEBI:47812 - (1S)-1,25-dihydroxy-24-oxocalciol

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ChEBI Name (1S)-1,25-dihydroxy-24-oxocalciol ChEBI ID CHEBI:47812 ChEBI ASCII Name (1S)-1,25-dihydroxy-24-oxocalciol Stars This entity has been manually annotated by the ChEBI Team. 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 C27H42O4 Net Charge 0 Average Mass 430.61998 Monoisotopic Mass 430.30831 InChI InChI=1S/C27H42O4/c1-17(8-13-25(30)26(3,4)31)22-11-12-23-19(7-6-14-27(22,23)5)9-10-20-15-21(28)16-24(29)18(20)2/h9-10,17,21-24,28-29,31H,2,6-8,11-16H2,1,3-5H3/b19-9+,20-10-/t17-,21-,22-,23+,24+,27-/m1/s1 InChIKey BWFQMABKLLTETH-YGQRWWDYSA-N SMILES [H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C)[C@H](C)CCC(=O)C(C)(C)O 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 (1S)-1,25-dihydroxy-24-oxocalciol (CHEBI:47812) has role human metabolite (CHEBI:77746) (1S)-1,25-dihydroxy-24-oxocalciol (CHEBI:47812) is a hydroxycalciol (CHEBI:47042) (1S)-1,25-dihydroxy-24-oxocalciol (CHEBI:47812) is a oxocalciol (CHEBI:47806) (1S)-1,25-dihydroxy-24-oxocalciol (CHEBI:47812) is a tertiary α-hydroxy ketone (CHEBI:139592) IUPAC Name (1S,3R,5Z,7E)-1,3,25-trihydroxy-9,10-secocholesta-5,7,10-trien-24-one Synonyms Sources (1S)-1,25-dihydroxy-24-oxocalciol UniProt 1,25-Dihydroxy-24-oxo-vitamin D3 ChemIDplus 1,25-Dihydroxy-24-oxocholecalciferol ChemIDplus 1α,25-dihydroxy-24-oxocholecalciferol LIPID MAPS 1α,25-dihydroxy-24-oxovitamin D3 LIPID MAPS 24-Kdhvd3 ChemIDplus 24-Keto-1,25-dihydroxyvitamin D3 ChemIDplus 24-oxo-1α,25(OH)2D3 ChEBI 24-oxo-1α,25-dihydroxycholecalciferol ChEBI 24-oxo-1α,25-dihydroxyvitamin D3 ChEBI Manual Xref Database LMST03020186 LIPID MAPS View more database links Registry Numbers Types Sources 6005336 Beilstein Registry Number Beilstein 76338-50-6 CAS Registry Number ChemIDplus Last Modified 06 February 2018