CHEBI:136650 - estriol 16-O-(β-D-glucuronide)(1−)

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ChEBI Name estriol 16-O-(β-D-glucuronide)(1−) ChEBI ID CHEBI:136650 ChEBI ASCII Name estriol 16-O-(beta-D-glucuronide)(1-) Definition A steroid glucuronide anion that is the conjugate base of estriol 16-O-(β-D-glucuronide) arising from deprotonation of the carboxylic acid function; 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 C24H31O9 Net Charge -1 Average Mass 463.498 Monoisotopic Mass 463.19736 InChI InChI=1S/C24H32O9/c1-24-7-6-13-12-5-3-11(25)8-10(12)2-4-14(13)15(24)9-16(21(24)29)32-23-19(28)17(26)18(27)20(33-23)22(30)31/h3,5,8,13-21,23,25-29H,2,4,6-7,9H2,1H3,(H,30,31)/p-1/t13-,14-,15+,16-,17+,18+,19-,20+,21+,23-,24+/m1/s1 InChIKey FQYGGFDZJFIDPU-JRSYHJKYSA-M SMILES C1[C@]2([C@]3([C@@](C4=C(C=C(O)C=C4)CC3)(CC[C@@]2([C@@H](O)[C@@H]1O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)C([O-])=O)C)[H])[H])[H] ChEBI Ontology Outgoing estriol 16-O-(β-D-glucuronide)(1−) (CHEBI:136650) is a β-D-glucosiduronate (CHEBI:83411) estriol 16-O-(β-D-glucuronide)(1−) (CHEBI:136650) is a estrane conjugate (CHEBI:167107) estriol 16-O-(β-D-glucuronide)(1−) (CHEBI:136650) is a steroid glucosiduronic acid anion (CHEBI:136637) estriol 16-O-(β-D-glucuronide)(1−) (CHEBI:136650) is conjugate base of estriol 16-O-(β-D-glucuronide) (CHEBI:766) Incoming estriol 16-O-(β-D-glucuronide) (CHEBI:766) is conjugate acid of estriol 16-O-(β-D-glucuronide)(1−) (CHEBI:136650) IUPAC Name 3,17β-dihydroxyestra-1,3,5(10)-trien-16α-yl β-D-glucopyranosiduronate Synonyms Sources 16α,17β-estriol 16-O-(β-D-glucuronate) UniProt 16α,17β-estriol 16-O-(β-D-glucuronide)(1−) SUBMITTER Citation Type Source 23288867 PubMed citation SUBMITTER Last Modified 22 June 2017