CHEBI:5684 - Heteratisine

ChEBI IDCHEBI:5684
ChEBI NameHeteratisine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H33NO5
Net Charge0
Average Mass391.508
Monoisotopic Mass391.23587
SMILES[H][C@]12C[C@@H]3CC[C@](O)([C@@H]4C5N(CC)C[C@]6(C)CC[C@H](OC)[C@@]51[C@]6([H])[C@@H]4O)[C@@]2([H])C(=O)O3
InChIInChI=1S/C22H33NO5/c1-4-23-10-20(2)7-6-13(27-3)22-12-9-11-5-8-21(26,14(12)19(25)28-11)15(18(22)23)16(24)17(20)22/h11-18,24,26H,4-10H2,1-3H3/t11-,12+,13-,14+,15-,16+,17+,18?,20-,21+,22-/m0/s1
InChIKeyYPSAOPXJHSESSR-AGBQGJAZSA-N
ChEBI Ontology
Outgoing Relation(s)
Heteratisine (CHEBI:5684) is a organic heterobicyclic compound (CHEBI:27171)
Heteratisine (CHEBI:5684) is a organonitrogen heterocyclic compound (CHEBI:38101)
Synonym  Source
HeteratisineKEGG COMPOUND
Manual XrefsDatabases
C08686KEGG COMPOUND
C00001642KNApSAcK
Registry NumbersSources
CAS:3328-84-5KEGG COMPOUND