input word = C00039656

Metabolite InformationStructural formula
Name Loxothyrin A
Formula C24H30O9
Mw 462.18898256
CAS RN 162762-96-1
C_ID C00039656 ,
InChIKey DESXTEYYECQGPC-UHFFFAOYNA-N
InChICode InChI=1S/C24H30O9/c1-12-15-7-16(28)19-23(8-15,20(12)29)21(30)32-11-24(19)17(9-25)22(4,10-31-13(2)26)6-5-18(24)33-14(3)27/h9,15-19,28H,1,5-8,10-11H2,2-4H3/t15-,16+,17+,18-,19-,22-,23+,24-/m0/s1
SMILES [C@H]12[C@@]3(C(=O)OC[C@]41[C@@H]([C@](CC[C@@H]4OC(=O)C)(C)COC(=O)C)C=O)C(=O)C(=C)[C@@H](C[C@H]2O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon japonicus Ref.
PlantaeLabiataeIsodon loxothyrsa Ref.
zoom in



OrganismIsodon loxothyrsa
ReferenceSun, et al., Diterpenoids from Isodon Species, Science Press, Beijing, (2001)