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CHEBI:3852 - Condelphine

ChEBI IDCHEBI:3852
ChEBI NameCondelphine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC25H39NO6
Net Charge0
Average Mass449.588
Monoisotopic Mass449.27774
SMILES[H][C@]12C[C@]3([H])[C@]([H])([C@H]1OC(C)=O)[C@](O)(C[C@@H]2OC)[C@H]1C[C@]2([H])[C@@]4(COC)CC[C@H](O)[C@]23C1N(CC)C4
InChIInChI=1S/C25H39NO6/c1-5-26-11-23(12-30-3)7-6-19(28)25-15-8-14-17(31-4)10-24(29,16(22(25)26)9-18(23)25)20(15)21(14)32-13(2)27/h14-22,28-29H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24+,25-/m1/s1
InChIKeyZEBMMHUDQRRILP-WZSMAATHSA-N
ChEBI Ontology
Outgoing Relation(s)
Condelphine (CHEBI:3852) is a diterpenoid (CHEBI:23849)
Synonym  Source
CondelphineKEGG COMPOUND
Manual XrefsDatabases
C08671KEGG COMPOUND
C00001627KNApSAcK
Registry NumbersSources
CAS:7633-69-4KEGG COMPOUND