input word = C00021686

Metabolite InformationStructural formula
Name Salonitenolide 8-O-angelate
Formula C20H26O4
Mw 330.18310932
CAS RN 80368-29-2
C_ID C00021686 ,
InChIKey HXMMJGIMTCOROX-DKFNUNEUNA-N
InChICode InChI=1S/C20H26O4/c1-6-14(4)19(21)23-16-10-12(2)8-7-9-13(3)11-17-18(16)15(5)20(22)24-17/h6,8,11,16-18H,5,7,9-10H2,1-4H3/b12-8+,13-11+,14-6-/t16-,17+,18+/m0/s1
SMILES C=C1C(=O)O[C@@H]2/C=C(C)CC/C=C(C)C[C@H](OC(=O)/C(C)=CC)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBrachylaena neriifolia Ref.
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