input word = C00043385

Metabolite InformationStructural formula
Name Chagresnone
(+)-Chagresnone
Formula C22H34O4
Mw 362.24570957
CAS RN 799269-23-1
C_ID C00043385 ,
InChIKey YEMYUZHZOZMLBB-BWMZSDLRNA-N
InChICode InChI=1S/C22H34O4/c1-13(24)26-11-16-19-14-6-7-17-20(2,12-23)8-5-9-21(17,3)15(14)10-18(25)22(16,19)4/h14-17,19,23H,5-12H2,1-4H3/t14-,15+,16+,17+,19-,20-,21-,22-/m1/s1
SMILES C1[C@H]2[C@H]([C@H]3[C@@](C1=O)([C@H]3COC(=O)C)C)CC[C@@H]1[C@@]2(CCC[C@@]1(CO)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMyrospermum frutescens Ref.
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