input word = C00007157

Metabolite InformationStructural formula
Name Isofissistin
(1R-trans)- (2,5-Dihydroxy-3,4,6-trimethoxyphenyl)[3-(4-methyl-3-pentenyl)-6-phenyl-3-cyclohexen-1-yl]methanone
Formula C28H34O6
Mw 466.23553882
CAS RN 169312-04-3
C_ID C00007157 ,
InChIKey LXKXXDWXWNBTNE-VJOGAFQXNA-N
InChICode InChI=1S/C28H34O6/c1-17(2)10-9-11-18-14-15-20(19-12-7-6-8-13-19)21(16-18)23(29)22-24(30)27(33-4)28(34-5)25(31)26(22)32-3/h6-8,10,12-14,20-21,30-31H,9,11,15-16H2,1-5H3/t20-,21+/m0/s1
SMILES [C@H]1(C(=O)c2c(c(c(c(c2O)OC)OC)O)OC)[C@@H](CC=C(C1)CCC=C(C)C)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeFissistigma lanuginosum Ref.
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