input word = C00047967

Metabolite InformationStructural formula
Name Ligupersin A
Formula C24H28O5
Mw 396.193674
CAS RN 134847-58-8
C_ID C00047967 ,
InChIKey HIQLOIOGTRDMIW-VFYKLCQLNA-N
InChICode InChI=1S/C24H28O5/c1-14-11-18(25)22-23(2,3)20(26)9-10-24(22,4)17(14)13-28-16-7-5-15-6-8-21(27)29-19(15)12-16/h5-8,11-12,17,20,22,26H,9-10,13H2,1-4H3/t17-,20-,22-,24+/m1/s1
SMILES [C@H]1(C(=CC(=O)[C@H]2[C@]1(CC[C@H](C2(C)C)O)C)C)COc1ccc2c(c1)oc(=O)cc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula assa-foetida Ref.
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