input word = C00020100

Metabolite InformationStructural formula
Name Gmelofuran
Hibiscone C
Formula C15H18O3
Mw 246.12559444
CAS RN 70863-78-4
C_ID C00020100 ,
InChIKey ITOFWMRNIIFZKF-SLOTWNJKNA-N
InChICode InChI=1S/C15H18O3/c1-7(2)9-5-12(16)11-6-18-15-13(11)10(9)4-8(3)14(15)17/h6-10H,4-5H2,1-3H3/t8-,9+,10+/m0/s1
SMILES C1C(=O)c2c3[C@@H]([C@H]1C(C)C)C[C@@H](C(=O)c3oc2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeGmelina arborea Ref.
PlantaeMalvaceaeHibiscus elatus Ref.
PlantaeMalvaceaeHibiscus taiwanensis Ref.
PlantaeMalvaceaeHibiscus tiliaceus Ref.
PlantaeMalvaceaeKydia calycina Ref.
zoom in