input word = C00044895

Metabolite InformationStructural formula
Name Ludongnin J
(-)-Ludongnin J
Formula C21H28O5
Mw 360.193674
CAS RN 623943-59-9
C_ID C00044895 ,
InChIKey USNFPPCRYZXOPG-SXYUFWLKNA-N
InChICode InChI=1S/C21H28O5/c1-12-13-5-6-14-20(11-26-18(23)21(14,9-13)16(12)22)8-4-7-19(2)10-25-17(24-3)15(19)20/h13-15,17H,1,4-11H2,2-3H3/t13-,14+,15-,17-,19+,20-,21+/m1/s1
SMILES C1[C@@H]2C[C@]3([C@@H](C1)[C@@]1(COC3=O)[C@H]3[C@@](CCC1)(CO[C@H]3OC)C)C(=O)C2=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon rubescens var.lushiensis Ref.
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OrganismIsodon rubescens var.lushiensis
ReferenceHan,J.Nat.Prod.,66,(2003),1391