CHEBI:4928 - Eupahyssopin

ChEBI IDCHEBI:4928
ChEBI NameEupahyssopin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H26O7
Net Charge0
Average Mass378.421
Monoisotopic Mass378.16785
SMILES[H][C@]12O[C@]1(CO)CC/C=C(\C)C[C@@H](OC(=O)/C(C)=C/CO)[C@@]1([H])C(=C)C(=O)O[C@]21[H]
InChIInChI=1S/C20H26O7/c1-11-5-4-7-20(10-22)17(27-20)16-15(13(3)19(24)26-16)14(9-11)25-18(23)12(2)6-8-21/h5-6,14-17,21-22H,3-4,7-10H2,1-2H3/b11-5+,12-6+/t14-,15-,16+,17-,20+/m1/s1
InChIKeyCWNJPEXNWXFLHM-RAMABSIPSA-N
ChEBI Ontology
Outgoing Relation(s)
Eupahyssopin (CHEBI:4928) is a fatty acid ester (CHEBI:35748)
Synonym  Source
EupahyssopinKEGG COMPOUND
Manual XrefsDatabases
C00003271KNApSAcK
C09433KEGG COMPOUND
Registry NumbersSources
CAS:57718-77-1KEGG COMPOUND