input word = C00048856

Metabolite InformationStructural formula
Name Solandelactone E
Formula C22H34O4
Mw 362.24570957
CAS RN 180468-71-7
C_ID C00048856 ,
InChIKey ZMCHHZFBGBLCJE-XELPJPABNA-N
InChICode InChI=1S/C22H34O4/c1-2-3-4-5-6-8-11-17(23)14-15-20(24)18-16-19(18)21-12-9-7-10-13-22(25)26-21/h6-9,14-15,17-21,23-24H,2-5,10-13,16H2,1H3/b8-6-,9-7-,15-14+/t17-,18+,19+,20+,21+/m0/s1
SMILES CCCCC/C=CC[C@H](O)/C=C/[C@H](O)[C@@H]1C[C@H]1[C@H]1C/C=CCCC(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Solanderia secunda Ref.
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