CHEBI:2437 - acronycine

ChEBI IDCHEBI:2437
ChEBI Nameacronycine
Stars
DefinitionAn alkaloid antineoplastic agent isolated from Acronychia baueri.
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H19NO3
Net Charge0
Average Mass321.376
Monoisotopic Mass321.13649
SMILESCOc1cc2c(c3c1c(=O)c1ccccc1n3C)C=CC(C)(C)O2
InChIInChI=1S/C20H19NO3/c1-20(2)10-9-13-15(24-20)11-16(23-4)17-18(13)21(3)14-8-6-5-7-12(14)19(17)22/h5-11H,1-4H3
InChIKeySMPZPKRDRQOOHT-UHFFFAOYSA-N
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
acronycine (CHEBI:2437) has role antineoplastic agent (CHEBI:35610)
acronycine (CHEBI:2437) has role metabolite (CHEBI:25212)
acronycine (CHEBI:2437) is a acridone derivatives (CHEBI:61878)
acronycine (CHEBI:2437) is a alkaloid (CHEBI:22315)
IUPAC Name 
6-methoxy-3,3,12-trimethyl-3,12-dihydro-7H-pyrano[2,3-c]acridin-7-one
Synonyms  Source
AcronycineKEGG COMPOUND
AcronineKEGG COMPOUND
3,12-dihydro-6-methoxy-3,3,12-trimethyl-7H-pyrano[2,3-c]acridin-7-oneNIST Chemistry WebBook
Manual XrefsDatabases
C10632KEGG COMPOUND
D02378KEGG DRUG
C00002130KNApSAcK
Registry NumbersSources
Beilstein:312954Beilstein
CAS:7008-42-6KEGG COMPOUND
CAS:7008-42-6NIST Chemistry WebBook
CAS:7008-42-6ChemIDplus