input word = C00031634

Metabolite InformationStructural formula
Name Boehmenan
Formula C40H40O12
Mw 712.25197674
CAS RN 57296-22-7
C_ID C00031634 ,
InChIKey OVFZHMPISOASDF-KAVGSWPWNA-N
InChICode InChI=1S/C40H40O12/c1-46-33-19-24(7-12-30(33)41)9-15-37(44)50-17-5-6-26-18-28-29(23-51-38(45)16-10-25-8-13-31(42)34(20-25)47-2)39(52-40(28)36(21-26)49-4)27-11-14-32(43)35(22-27)48-3/h7-16,18-22,29,39,41-43H,5-6,17,23H2,1-4H3/b15-9+,16-10+/t29-,39-/m0/s1
SMILES c1c(c(cc(c1)/C=C/C(=O)OCCCc1cc2c(c(c1)OC)O[C@H]([C@H]2COC(=O)/C=C/c1ccc(c(c1)OC)O)c1ccc(c(c1)OC)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeDurio zibethinus Ref.
PlantaeMalvaceaeHibiscus taiwanensis Ref.
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