CHEBI:2988 - Baloxine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Baloxine
ChEBI ID CHEBI:2988
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H24N2O4
Net Charge 0
Average Mass 368.427
Monoisotopic Mass 368.17361
InChI InChI=1S/C21H24N2O4/c1-12(24)20-9-13(25)11-23-8-7-21(19(20)23)15-5-3-4-6-16(15)22-17(21)14(10-20)18(26)27-2/h3-6,12,19,22,24H,7-11H2,1-2H3/t12-,19-,20-,21-/m0/s1
InChIKey CQSFDKICYDHRGT-XSGSXHBCSA-N
SMILES COC(=O)C1=C2Nc3ccccc3[C@@]22CCN3CC(=O)C[C@](C1)([C@H](C)O)[C@@H]23
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 Baloxine (CHEBI:2988) is a alkaloid (CHEBI:22315)
Baloxine (CHEBI:2988) is a methyl ester (CHEBI:25248)
Synonym Source
Baloxine KEGG COMPOUND
Manual Xref Database
C09045 KEGG COMPOUND
View more database links
Registry Number Type Source
38225-09-1 CAS Registry Number KEGG COMPOUND
Last Modified
09 March 2018