CHEBI:3748 - Clivoline

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ChEBI Name Clivoline ChEBI ID CHEBI:3748 Stars This entity has been manually annotated by a third party. 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 C21H27NO7 Net Charge 0 Average Mass 405.442 Monoisotopic Mass 405.17875 InChI InChI=1S/C21H27NO7/c1-6-15-11-13(2)21(4,29-14(3)23)20(26)27-12-16-7-9-22(5)10-8-17(18(16)24)28-19(15)25/h6-7,11,13,17H,1,8-10,12H2,2-5H3/b15-11-,16-7-/t13-,17-,21+/m1/s1 InChIKey LIEIOJNANXUNDT-WIOQBUNOSA-N SMILES C[C@@H]1\C=C(C=C)/C(=O)O[C@@H]2CCN(C)C\C=C(\COC(=O)[C@@]1(C)OC(C)=O)C2=O ChEBI Ontology Outgoing Clivoline (CHEBI:3748) is a carboxylic ester (CHEBI:33308) Clivoline (CHEBI:3748) is a ketone (CHEBI:17087) Synonym Source Clivoline KEGG COMPOUND Manual Xrefs Databases C00002082 KNApSAcK C10282 KEGG COMPOUND View more database links Registry Number Type Source 33979-15-6 CAS Registry Number KEGG COMPOUND Last Modified 28 July 2014