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CHEBI:5375 - Glaucolide B

ChEBI IDCHEBI:5375
ChEBI NameGlaucolide B
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H26O10
Net Charge0
Average Mass438.429
Monoisotopic Mass438.15260
SMILES[H][C@]12O[C@]1(C)CCC(=O)[C@](C)(OC(C)=O)C[C@H](OC(C)=O)C1=C(COC(C)=O)C(=O)O[C@@]12[H]
InChIInChI=1S/C21H26O10/c1-10(22)27-9-13-16-14(28-11(2)23)8-21(5,30-12(3)24)15(25)6-7-20(4)18(31-20)17(16)29-19(13)26/h14,17-18H,6-9H2,1-5H3/t14-,17-,18+,20+,21+/m0/s1
InChIKeyJNLNEIIZZQABDP-ZBWGKUOUSA-N
ChEBI Ontology
Outgoing Relation(s)
Glaucolide B (CHEBI:5375) is a carboxylic ester (CHEBI:33308)
Glaucolide B (CHEBI:5375) is a ketone (CHEBI:17087)
Synonym  Source
Glaucolide BKEGG COMPOUND
Manual XrefsDatabases
C00003291KNApSAcK
C09465KEGG COMPOUND
Registry NumbersSources
CAS:11091-27-3KEGG COMPOUND