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CHEBI:4402 - Denudatine

ChEBI IDCHEBI:4402
ChEBI NameDenudatine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H33NO2
Net Charge0
Average Mass343.511
Monoisotopic Mass343.25113
SMILES[H][C@@]12CC3[C@H]4N(CC)C[C@]1(C)CCC[C@]42[C@]1([H])[C@@H](O)[C@@H]2CC[C@]31[C@H](O)C2=C
InChIInChI=1S/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14?,15-,16+,17-,18-,19-,20+,21+,22+/m1/s1
InChIKeyOVXLNQAYPUEDSI-CNEDWAKUSA-N
ChEBI Ontology
Outgoing Relation(s)
Denudatine (CHEBI:4402) has parent hydride atisane (CHEBI:36471)
Denudatine (CHEBI:4402) is a diterpenoid (CHEBI:23849)
Synonym  Source
DenudatineKEGG COMPOUND
Manual XrefsDatabases
C08680KEGG COMPOUND
C00001636KNApSAcK
C00028165KNApSAcK
Registry NumbersSources
CAS:26166-37-0KEGG COMPOUND