CHEBI:4380 - Delcorine

ChEBI IDCHEBI:4380
ChEBI NameDelcorine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC26H41NO7
Net Charge0
Average Mass479.614
Monoisotopic Mass479.28830
SMILES[H][C@]12C[C@]3([H])[C@]([H])([C@H]1OC)[C@@]1(C[C@@H]2OC)OCO[C@]12C1N(CC)C[C@]4(COC)CC[C@H](OC)[C@@]13[C@]4([H])[C@@H]2O
InChIInChI=1S/C26H41NO7/c1-6-27-11-23(12-29-2)8-7-17(31-4)25-15-9-14-16(30-3)10-24(18(15)19(14)32-5)26(22(25)27,34-13-33-24)21(28)20(23)25/h14-22,28H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24-,25+,26-/m1/s1
InChIKeyXTLROSDJDZHIIK-VIGIWSGCSA-N
ChEBI Ontology
Outgoing Relation(s)
Delcorine (CHEBI:4380) is a diterpenoid (CHEBI:23849)
Synonym  Source
DelcorineKEGG COMPOUND
Manual XrefsDatabases
C08675KEGG COMPOUND
C00001631KNApSAcK
Registry NumbersSources
CAS:52358-55-1KEGG COMPOUND