input word = C00021389

Metabolite InformationStructural formula
Name Ferutinin
Jaeschkeanadiol p-hydroxybenzoate
Formula C22H30O4
Mw 358.21440945
CAS RN 41743-44-6
C_ID C00021389 ,
InChIKey CYSHNJQMYORNJI-ULISFMATNA-N
InChICode InChI=1S/C22H30O4/c1-14(2)22(25)12-11-21(4)10-9-15(3)13-18(19(21)22)26-20(24)16-5-7-17(23)8-6-16/h5-9,14,18-19,23,25H,10-13H2,1-4H3/t18-,19+,21-,22+/m0/s1
SMILES [C@@]12([C@@H]([C@H](CC(=CC1)C)OC(=O)c1ccc(cc1)O)[C@@](CC2)(C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula elaeochytris Ref.
PlantaeApiaceaeFerula hermonis Ref.
PlantaeApiaceaeFerula kuhistanica Ref.
PlantaeApiaceaeFerula lancerottensis Ref.
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