input word = C00020031

Metabolite InformationStructural formula
Name (9S,10R)-9,10,11-Trihydroxyumbelliprenin
Formula C24H32O6
Mw 416.21988875
CAS RN
C_ID C00020031 ,
InChIKey PWGFIVDGCMQGCD-KOCDMIMYNA-N
InChICode InChI=1S/C24H32O6/c1-16(6-5-7-17(2)14-20(25)23(27)24(3,4)28)12-13-29-19-10-8-18-9-11-22(26)30-21(18)15-19/h7-12,15,20,23,25,27-28H,5-6,13-14H2,1-4H3/b16-12+,17-7+/t20-,23+/m0/s1
SMILES c1c(cc2c(c1)ccc(=O)o2)OC/C=C(/CC/C=C(/C[C@@H]([C@H](C(O)(C)C)O)O)\C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeHeptaptera anisoptera Ref.
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