CHEBI:175411 - 19-Noraldosterone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 19-Noraldosterone
ChEBI ID CHEBI:175411
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H26O5
Net Charge 0
Average Mass 346.423
Monoisotopic Mass 346.17802
InChI InChI=1S/C20H26O5/c21-9-18(25)16-6-5-15-14-3-1-11-7-12(23)2-4-13(11)19(14)17(24)8-20(15,16)10-22/h7,10,13-17,19,21,24H,1-6,8-9H2/t13-,14-,15-,16+,17-,19+,20+/m0/s1
InChIKey BIDXSZCVYXAGCG-CRGXURCLSA-N
SMILES O[C@@H]1[C@]2([C@]([C@]3([C@@]([C@H](CC3)C(=O)CO)(C1)C=O)[H])(CCC=4[C@@]2(CCC(=O)C4)[H])[H])[H]
ChEBI Ontology
Outgoing 19-Noraldosterone (CHEBI:175411) is a 21-hydroxy steroid (CHEBI:35344)
IUPAC Name
(8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-13-carbaldehyde
Manual Xrefs Databases
112845 ChemSpider
HMDB0041795 HMDB
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Registry Number Type Source
76025-75-7 CAS Registry Number ChemIDplus