input word = C00036772

Metabolite InformationStructural formula
Name Assafoetidnol A
(-)-Assafoetidnol A
Formula C24H30O5
Mw 398.20932407
CAS RN 403642-10-4
C_ID C00036772 ,
InChIKey DPUIHKUQXKLJMN-FBHOYFJKNA-N
InChICode InChI=1S/C24H30O5/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/h5-8,12,17-18,20,22,25-26H,1,9-11,13H2,2-4H3/t17-,18+,20+,22+,24+/m0/s1
SMILES C1(=C)C[C@H]([C@H]2[C@@]([C@H]1COc1ccc3c(c1)oc(=O)cc3)(CC[C@H](C2(C)C)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula assa-foetida Ref.
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