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CHEBI:9290 - strigol

ChEBI IDCHEBI:9290
ChEBI Namestrigol
Stars
DefinitionA strigolactone in which the tricyclic lactone moiety bears a hydroxy substitutuent at the position para to the gem-dimethyl group.
Last Modified9 April 2020
DownloadsMolfile
FormulaC19H22O6
Net Charge0
Average Mass346.379
Monoisotopic Mass346.14164
SMILES[H][C@]12OC(=O)/C(=C/O[C@H]3C=C(C)C(=O)O3)[C@@]1([H])CC1=C2C(C)(C)CC[C@@H]1O
InChIInChI=1S/C19H22O6/c1-9-6-14(24-17(9)21)23-8-12-10-7-11-13(20)4-5-19(2,3)15(11)16(10)25-18(12)22/h6,8,10,13-14,16,20H,4-5,7H2,1-3H3/b12-8+/t10-,13+,14-,16+/m1/s1
InChIKeyVOFXXOPWCBSPAA-KCNJUGRMSA-N
Roles Classification
Biological Role:
plant hormone  A plant growth regulator that modulates the formation of stems, leaves and flowers, as well as the development and ripening of fruit. The term includes endogenous and non-endogenous compounds (e.g. active compounds produced by bacteria on the leaf surface) as well as semi-synthetic and fully synthetic compounds.
ChEBI Ontology
Outgoing Relation(s)
strigol (CHEBI:9290) is a indenofuran (CHEBI:149453)
strigol (CHEBI:9290) is a secondary alcohol (CHEBI:35681)
strigol (CHEBI:9290) is a strigolactone (CHEBI:68487)
IUPAC Name 
(3E,3aR,5S,8bS)-5-hydroxy-8,8-dimethyl-3-({[(2R)-4-methyl-5-oxo-2,5-dihydrofuran-2-yl]oxy}methylene)-3,3a,4,5,6,7,8,8b-octahydro-2H-indeno[1,2-b]furan-2-one
Synonyms  Source
StrigolKEGG COMPOUND
(+)-strigolChEBI
Manual XrefsDatabases
C09190KEGG COMPOUND
US2008318773Patent
C00003486KNApSAcK
Registry NumbersSources
Reaxys:1299462Reaxys
CAS:11017-56-4KEGG COMPOUND
CAS:11017-56-4ChemIDplus
Citations