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CHEBI:191456 - Sterebin G

ChEBI IDCHEBI:191456
ChEBI NameSterebin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H34O5
Net Charge0
Average Mass354.487
Monoisotopic Mass354.24062
SMILESC=C(/C=C/C1C(C)(O)C(O)C(O)C2C(C)(C)CCCC21C)C(O)CO
InChIInChI=1S/C20H34O5/c1-12(13(22)11-21)7-8-14-19(4)10-6-9-18(2,3)16(19)15(23)17(24)20(14,5)25/h7-8,13-17,21-25H,1,6,9-11H2,2-5H3/b8-7+
InChIKeyVJXXTZUXTRIHAZ-BQYQJAHWSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
Sterebin G (CHEBI:191456) is a diterpenoid (CHEBI:23849)
IUPAC Name 
4-[(E)-4,5-dihydroxy-3-methylidenepent-1-enyl]-3,4a,8,8-tetramethyl-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,2,3-triol
Manual XrefsDatabases
HMDB0035380HMDB
35013917ChemSpider