input word = C00045157

Metabolite InformationStructural formula
Name 16-Acetoxycoleon U 11-acetate
Formula C24H30O8
Mw 446.19406794
CAS RN 328946-32-3
C_ID C00045157 ,
InChIKey KSHBYAFCTIHCOD-GWYYVJSXNA-N
InChICode InChI=1S/C24H30O8/c1-11(10-31-12(2)25)14-17(27)15-16(21(19(14)29)32-13(3)26)24(6)9-7-8-23(4,5)22(24)20(30)18(15)28/h11,27,29-30H,7-10H2,1-6H3/t11-,24+/m0/s1
SMILES CC(=O)OCC(C)c1c(O)c(OC(C)=O)c2c(c1O)C(=O)C(O)=C1C(C)(C)CCC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLamiaceaeColeus xanthanthus Ref.
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OrganismColeus xanthanthus
ReferenceMei,J.Nat.Prod.,65,(2002),634