CHEBI:9960 - Vernodalol

ChEBI IDCHEBI:9960
ChEBI NameVernodalol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H24O8
Net Charge0
Average Mass392.404
Monoisotopic Mass392.14712
SMILES[H][C@]12C(=C)C(=O)OC[C@@]1(C=C)C[C@H](OC(=O)C(=C)CO)[C@@H](C(=C)C(=O)OC)[C@@H]2O
InChIInChI=1S/C20H24O8/c1-6-20-7-13(28-17(23)10(2)8-21)14(11(3)18(24)26-5)16(22)15(20)12(4)19(25)27-9-20/h6,13-16,21-22H,1-4,7-9H2,5H3/t13-,14+,15+,16-,20+/m0/s1
InChIKeyFZALQGCQQJLGKE-BBNZOYGDSA-N
ChEBI Ontology
Outgoing Relation(s)
Vernodalol (CHEBI:9960) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
VernodalolKEGG COMPOUND
Manual XrefsDatabases
C09577KEGG COMPOUND
C00003385KNApSAcK
Registry NumbersSources
CAS:65388-17-2KEGG COMPOUND