input word = C00002442

Metabolite InformationStructural formula
Name Ptaeroglycol
Formula C15H14O6
Mw 290.07903818
CAS RN 18836-12-9
C_ID C00002442 ,
InChIKey IVVDHMXDSFGHMC-UHFFFAOYNA-N
InChICode InChI=1S/C15H14O6/c1-8-4-10(17)13-12(21-8)5-11-9(14(13)18)2-3-15(19,6-16)7-20-11/h2-5,16,18-19H,6-7H2,1H3/t15-/m0/s1
SMILES Cc1cc(=O)c2c(O)c3c(cc2o1)OCC(O)(CO)C=C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePterodon obliquum Ref.
PlantaeMeliaceaeCedrelopsis grevei Ref.
PlantaeRutaceaeCneorum pulverulentum Ref.
PlantaeRutaceaeCneorum tricoccum Ref.
PlantaeRutaceaePtaeroxylon obliquum Ref.
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OrganismCneorum pulverulentum
ReferenceBuckingham, et al., Dictionary of Org Compds. 5th ed., London, Chapman & Hall, (1982).

Dean, et al., Tetrahedron Lett, (1967), 3459.

Mondon, et al., Chem Ber, 108, (1975), 2005.

Gonzalez, et al., Planta Med, 47, (1983), 56

Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter34