input word = C00021381

Metabolite InformationStructural formula
Name 4beta,8beta,2alpha-Trihydroxy-6alpha-p-hydroxybenzoyloxydaucane
Formula C22H32O6
Mw 392.21988875
CAS RN 128397-56-8
C_ID C00021381 ,
InChIKey QCLJCHLNAUUSNX-GWCKPLBNNA-N
InChICode InChI=1S/C22H32O6/c1-13(2)22(27)10-9-20(3)12-17(24)21(4,26)11-16(18(20)22)28-19(25)14-5-7-15(23)8-6-14/h5-8,13,16-18,23-24,26-27H,9-12H2,1-4H3/t16-,17-,18+,20+,21-,22+/m0/s1
SMILES [C@@]12([C@@H]([C@H](C[C@]([C@H](C1)O)(C)O)OC(=O)c1ccc(cc1)O)[C@@](CC2)(C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula sinaica Ref.
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