CHEBI:6566 - lunarine

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ChEBI Name lunarine
ChEBI ID CHEBI:6566
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C25H31N3O4
Net Charge 0
Average Mass 437.53146
Monoisotopic Mass 437.231
InChI InChI=1S/C25H31N3O4/c29-19-8-10-25-11-9-24(31)27-14-2-1-12-26-13-3-15-28-23(30)7-5-18-4-6-21(20(25)16-18)32-22(25)17-19/h4-7,9,11,16,22,26H,1-3,8,10,12-15,17H2,(H,27,31)(H,28,30)/b7-5+,11-9+/t22-,25+/m1/s1
InChIKey YIWJEBPTHXRHQF-LLMLIWGDSA-N
SMILES [H][C@@]12CC(=O)CC[C@@]11\C=C\C(=O)NCCCCNCCCNC(=O)\C=C\c3ccc(O2)c1c3
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing lunarine (CHEBI:6566) is a alkaloid fundamental parent (CHEBI:35506)
lunarine (CHEBI:6566) is a spermidine alkaloid (CHEBI:38524)
IUPAC Name
lunarine
Synonym Source
Lunarine KEGG COMPOUND
Manual Xrefs Databases
C00002348 KNApSAcK
C10603 KEGG COMPOUND
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Registry Numbers Types Sources
24185-51-1 CAS Registry Number KEGG COMPOUND
24185-51-1 CAS Registry Number ChemIDplus
62985 Beilstein Registry Number Beilstein
Last Modified
28 July 2014