input word = C00008649

Metabolite InformationStructural formula
Name Bonanniol B
Formula C26H30O6
Mw 438.20423869
CAS RN 96917-37-2
C_ID C00008649 ,
InChIKey PCDCRSMTQCVANJ-NTHCFPEMNA-N
InChICode InChI=1S/C26H30O6/c1-15(2)6-5-7-16(3)8-13-19-20(28)14-21-22(26(19)31-4)23(29)24(30)25(32-21)17-9-11-18(27)12-10-17/h6,8-12,14,24-25,27-28,30H,5,7,13H2,1-4H3/b16-8+/t24-,25+/m0/s1
SMILES c1(c(c2c(cc1O)O[C@@H]([C@H](C2=O)O)c1ccc(cc1)O)OC)C/C=C(/CCC=C(C)C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeBonannia graeca Ref.
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