EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:3624 - Chlorochrymorin

ChEBI IDCHEBI:3624
ChEBI NameChlorochrymorin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H19ClO5
Net Charge0
Average Mass314.765
Monoisotopic Mass314.09210
SMILES[H][C@]12OC(=O)C(=C)[C@]1([H])C[C@@]([H])([C@H](C)O)[C@@]13O[C@]1([H])[C@@H](Cl)[C@](C)(O)[C@]23[H]
InChIInChI=1S/C15H19ClO5/c1-5-7-4-8(6(2)17)15-10(9(7)20-13(5)18)14(3,19)11(16)12(15)21-15/h6-12,17,19H,1,4H2,2-3H3/t6-,7-,8-,9-,10-,11+,12+,14+,15-/m0/s1
InChIKeyVTKBHHKUNBJMHE-HWXSHQRMSA-N
ChEBI Ontology
Outgoing Relation(s)
Chlorochrymorin (CHEBI:3624) is a oxanes (CHEBI:46942)
Synonym  Source
ChlorochrymorinKEGG COMPOUND
Manual XrefsDatabases
C09358KEGG COMPOUND
C00000240KNApSAcK
Registry NumbersSources
CAS:52525-23-2KEGG COMPOUND