input word = C00048067

Metabolite InformationStructural formula
Name Polyanthinin
(-)-Polyanthinin
Formula C26H32O5
Mw 424.22497413
CAS RN 54631-85-5
C_ID C00048067 ,
InChIKey MNGYOFNIAOWXIT-CUYIBOSMNA-N
InChICode InChI=1S/C26H32O5/c1-16-6-10-22-25(3,4)23(30-17(2)27)12-13-26(22,5)20(16)15-29-19-9-7-18-8-11-24(28)31-21(18)14-19/h7-9,11,14,20,22-23H,1,6,10,12-13,15H2,2-5H3/t20-,22-,23+,26-/m1/s1
SMILES C1(=C)CC[C@H]2[C@@]([C@@H]1COc1ccc3c(c1)oc(=O)cc3)(CC[C@@H](C2(C)C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula assa-foetida Ref.
PlantaeApiaceaeFerula assafoetida Ref.
PlantaeApiaceaeFerula polyantha Ref.
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OrganismFerula polyantha
ReferenceKhasanov,Khim.Prir.Soedin.,(1974),517