About: 16-epiestriol 16-O-(beta-D-glucuronide)(1-)

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About: 16-epiestriol 16-O-(beta-D-glucuronide)(1-) Goto Sponge NotDistinct Permalink

An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

anion

Attributes	Values
rdf:type	Item
description	anion (en) аніон (uk)
rdfs:label	16-epiestriol 16-O-(beta-D-glucuronide)(1-) (en)
skos:prefLabel	16-epiestriol 16-O-(beta-D-glucuronide)(1-) (en)
name	16-epiestriol 16-O-(beta-D-glucuronide)(1-) (en)
isomeric SMILES	wds:Q74410982-7DA60568-E690-4D54-92E9-39F88A144029
stereoisomer of	wds:Q74410982-7E4C1C48-2E4C-4F42-A7F2-22B06C222B23
isomeric SMILES	C1=C2C(CC[C@]3([C@@]4(C[C@@H]([C@@H]([C@]4(CC[C@@]32[H])C)O)O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)C([O-])=O)[H])[H])=CC(=C1)O
stereoisomer of	estriol 16-O-(beta-D-glucuronide)(1-)
instance of	wds:Q74410982-88CD2CC5-605E-4591-92DF-63AF6294D7BB
instance of	type of chemical entity
subclass of	wds:Q74410982-47649FF6-D701-4E83-8F88-A7B76CEC7AB3 wds:Q74410982-CC97407A-AC0A-447C-91A5-19480BBEB4F5
subclass of	organic anion monocarboxylic acid anion
UniChem compound ID	wds:Q74410982-232FF97C-66CF-45D3-8707-CD5429481A4F
canonical SMILES	wds:Q74410982-67C16E46-665C-46B3-A823-94873D34EE1B
InChI	wds:Q74410982-708998CE-B0D8-44B3-8C94-0726D14FCC2A
InChIKey	wds:Q74410982-DB5AE167-AD29-477D-9143-D0734959B5CC
chemical formula	wds:Q74410982-C70486E2-F49A-4356-A70E-1B15AE8F6248
PubChem CID	wds:Q74410982-5B38046F-B307-48FA-8D01-E2FB403C59E4
ChEBI ID	wds:Q74410982-B47FC349-5B3F-4464-A53A-D275850B106E
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID126843467
ChEBI ID	http://purl.obolibrary.org/obo/CHEBI_136886
UniChem compound ID	154683098
canonical SMILES	CC12CCC3c4ccc(O)cc4CCC3C1CC(OC1OC(C(=O)[O-])C(O)C(O)C1O)C2O
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-FFLBMIEMSA-M
chemical formula	C₂₄H₃₁O₉⁻
PubChem CID	126843467
ChEBI ID	136886
skos:altLabel	17-epiestriol 16-O-(beta-D-glucuronide)(1-) (en)
mass	wds:Q74410982-D4EEAF91-62F1-4188-9947-AB0A92ED07E2
mass	463.19735615190984 (xsd:decimal)
is owl:sameAs of	16-epiestriol 16-O-(beta-D-glucuronide)(1-)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q74410982
is stereoisomer of of	estriol 16-O-(beta-D-glucuronide)(1-)
is stereoisomer of of	wds:Q74410832-64B5395C-141F-43C5-AB4D-5AC94BD8793A
is main subject of	Regiospecificity and stereospecificity of human UDP-glucuronosyltransferases in the glucuronidation of estriol, 16-epiestriol, 17-epiestriol, and 13-epiestradiol
is main subject of	wds:Q44198256-D16283FA-232F-46C5-838F-58DA31F59B76

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