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CHEBI:9235 - Spiramine A

ChEBI IDCHEBI:9235
ChEBI NameSpiramine A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC24H33NO4
Net Charge0
Average Mass399.531
Monoisotopic Mass399.24096
SMILES[H][C@@]12C[C@H]3O[C@H]4N5CCO[C@@H]5[C@]1(C)CCC[C@]42[C@]1([H])C[C@@H]2CC[C@]31[C@@H](OC(C)=O)C2=C
InChIInChI=1S/C24H33NO4/c1-13-15-5-8-24(19(13)28-14(2)26)17(11-15)23-7-4-6-22(3)16(23)12-18(24)29-21(23)25-9-10-27-20(22)25/h15-21H,1,4-12H2,2-3H3/t15-,16+,17-,18+,19-,20+,21+,22+,23-,24+/m0/s1
InChIKeyZPELMDXCJZDIBP-OWOZRORESA-N
ChEBI Ontology
Outgoing Relation(s)
Spiramine A (CHEBI:9235) has parent hydride atisane (CHEBI:36471)
Spiramine A (CHEBI:9235) is a diterpenoid (CHEBI:23849)
Synonym  Source
Spiramine AKEGG COMPOUND
Manual XrefsDatabases
C08709KEGG COMPOUND
C00001665KNApSAcK
Registry NumbersSources
CAS:114531-28-1KEGG COMPOUND