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CHEBI:8910 - Rugosal

ChEBI IDCHEBI:8910
ChEBI NameRugosal
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCC(C)[C@H]1CC[C@]2(C)C[C@@H]3OO[C@]12[C@@H](O)C=C3C=O
InChIInChI=1S/C15H22O4/c1-9(2)11-4-5-14(3)7-12-10(8-16)6-13(17)15(11,14)19-18-12/h6,8-9,11-13,17H,4-5,7H2,1-3H3/t11-,12+,13+,14-,15+/m1/s1
InChIKeyNTVXLOKDTRVPSZ-FQKPHLNHSA-N
ChEBI Ontology
Outgoing Relation(s)
Rugosal (CHEBI:8910) is a dioxanes (CHEBI:46926)
Synonym  Source
RugosalKEGG COMPOUND
Manual XrefsDatabases
C09717KEGG COMPOUND
C00003180KNApSAcK
Registry NumbersSources
CAS:121387-05-1KEGG COMPOUND