input word = C00012114

Metabolite InformationStructural formula
Name Ladibranolide
Formula C20H24O6
Mw 360.1572885
CAS RN 109361-82-2
C_ID C00012114 ,
InChIKey RGICTLGHLBXZLL-XDUBJMEUNA-N
InChICode InChI=1S/C20H24O6/c1-6-10(2)18(22)25-15-9-20(5)16(21)8-13(26-20)11(3)7-14-17(15)12(4)19(23)24-14/h6,8,11,14-15,17H,4,7,9H2,1-3,5H3/b10-6-/t11-,14-,15-,17-,20?/m1/s1
SMILES [C@]12(C[C@H]([C@H]3[C@@H](C[C@H](C(=CC1=O)O2)C)OC(=O)C3=C)OC(=O)/C(=C\C)/C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeViguiera ladibractate Ref.
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