input word = C00054439

Metabolite InformationStructural formula
Name Bisnorquassin
Formula C20H24O6
Mw 360.1572885
CAS RN 21018-87-1
C_ID C00054439
InChIKey WKNPIBKVHHVICI-DIPGMJKUSA-N
InChICode InChI=1S/C20H24O6/c1-8-5-12(21)20(24)19(4)10(8)6-13-18(3)11(7-14(22)25-13)9(2)15(23)16(26-20)17(18)19/h7-8,10,13,16-17,23-24H,5-6H2,1-4H3/t8-,10+,13-,16-,17+,18-,19+,20+/m1/s1
SMILES O=C1C[C@@H](C)[C@]([C@]2(C)[C@@]1(O)O3)([H])C[C@@]4([H])OC(C=C5[C@@]4(C)[C@]2([H])[C@@]3([H])C(O)=C5C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaeQuassia amara Ref.
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