input word = C00012083

Metabolite InformationStructural formula
Name (-)-Blumealactone C
Blumealactone C
Formula C17H24O6
Mw 324.1572885
CAS RN 111545-48-3
C_ID C00012083 ,
InChIKey ZZIWIHVMLLHIPS-ZRXZSUNXNA-N
InChICode InChI=1S/C17H24O6/c1-8-6-5-7-17(4)15(23-17)12(19)11-9(2)16(20)22-14(11)13(8)21-10(3)18/h8,11-15,19H,2,5-7H2,1,3-4H3/t8-,11-,12-,13-,14+,15-,17-/m1/s1
SMILES [C@@H]1([C@H]([C@@H]2[C@@H]([C@H]([C@@H]3[C@@](CCC1)(O3)C)O)C(=C)C(=O)O2)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBlumea balsamifera Ref.
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OrganismBlumea balsamifera
ReferenceFujimoto,Phytochem.,27,(1988),1109