CHEBI:6595 - Lyconnotine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Lyconnotine
ChEBI ID CHEBI:6595
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H25NO3
Net Charge 0
Average Mass 291.386
Monoisotopic Mass 291.18344
InChI InChI=1S/C17H25NO3/c1-12(16(20)21-2)11-17-13-5-3-9-18(17)10-4-6-14(17)15(19)8-7-13/h3,5,7,12,14-15,19H,4,6,8-11H2,1-2H3/t12?,14-,15-,17-/m1/s1
InChIKey YHPKLMGYAYSJRU-UYPCIZBGSA-N
SMILES COC(=O)C(C)C[C@@]12[C@@H]3CCCN1CC=CC2=CC[C@H]3O
ChEBI Ontology
Outgoing Lyconnotine (CHEBI:6595) is a citraconoyl group (CHEBI:23315)
Synonym Source
Lyconnotine KEGG COMPOUND
Manual Xrefs Databases
C00001947 KNApSAcK
C00028509 KNApSAcK
C09881 KEGG COMPOUND
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Registry Number Type Source
6900-93-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014