Term: | 6-ketoestriol |
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Accession: | CHEBI:145763
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Definition: | A 3-hydroxy steroid that is estriol carrying an oxo group at position 6. |
Synonyms: | exact_synonym: | 3,16alpha,17beta-trihydroxyestra-1,3,5(10)-trien-6-one |
| related_synonym: | (1R,2R,3aS,3bR,9bS,11aS)-1,2,7-trihydroxy-11a-methyl-1,2,3,3a,3b,4,9b,10,11,11a-decahydro-5H-cyclopenta[a]phenanthren-5-one; 6-oxo-16alpha,17beta-estriol; 6-oxo-estriol; 6-oxoestratriol; 6-oxoestriol; Formula=C18H22O4; InChI=1S/C18H22O4/c1-18-5-4-11-10-3-2-9(19)6-13(10)15(20)7-12(11)14(18)8-16(21)17(18)22/h2-3,6,11-12,14,16-17,19,21-22H,4-5,7-8H2,1H3/t11-,12-,14+,16-,17+,18+/m1/s1; InChIKey=PYFIDTBVOMQKDC-XCYHEEQWSA-N; SMILES=O[C@@H]1[C@@]2([C@]([C@]3([C@](CC2)(C4=C(C(=O)C3)C=C(O)C=C4)[H])[H])(C[C@H]1O)[H])C |
| xref: | CAS:7323-86-6; FooDB:FDB022098; HMDB:HMDB0000530; LIPID_MAPS_instance:LMST02010053; PMID:14412941; PMID:30450336 |
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