CHEBI:68634 - cortisol phosphate

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ChEBI Name cortisol phosphate ChEBI ID CHEBI:68634 Definition A steroid phosphate that is the 21-O-phospho derivative of cortisol. 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 C21H31O8P Net Charge 0 Average Mass 442.43980 Monoisotopic Mass 442.17565 InChI InChI=1S/C21H31O8P/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h9,14-16,18,23,25H,3-8,10-11H2,1-2H3,(H2,26,27,28)/t14-,15-,16-,18+,19-,20-,21-/m0/s1 InChIKey BGSOJVFOEQLVMH-VWUMJDOOSA-N SMILES [H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@@H](O)C[C@@]1(C)[C@@]2([H])CC[C@]1(O)C(=O)COP(O)(O)=O ChEBI Ontology Outgoing cortisol phosphate (CHEBI:68634) is a 11β-hydroxy steroid (CHEBI:35346) cortisol phosphate (CHEBI:68634) is a 17α-hydroxy steroid (CHEBI:35342) cortisol phosphate (CHEBI:68634) is a 3-oxo-Δ4 steroid (CHEBI:47909) cortisol phosphate (CHEBI:68634) is a cortisol ester (CHEBI:23396) cortisol phosphate (CHEBI:68634) is a steroid phosphate (CHEBI:36944) cortisol phosphate (CHEBI:68634) is a tertiary α-hydroxy ketone (CHEBI:139592) cortisol phosphate (CHEBI:68634) is conjugate acid of cortisol phosphate(2−) (CHEBI:68633) Incoming cortisol phosphate(2−) (CHEBI:68633) is conjugate base of cortisol phosphate (CHEBI:68634) IUPAC Name (11β)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl dihydrogen phosphate Synonyms Sources Cortisol 21-phosphate ChemIDplus Cortisol phosphate ChemIDplus Hydrocortisone 21-phosphate ChemIDplus Registry Numbers Types Sources 3182634 Reaxys Registry Number Reaxys 3863-59-0 CAS Registry Number ChemIDplus Citation Type Source 1894035 PubMed citation Europe PMC Last Modified 07 February 2018