input word = C00050361

Metabolite InformationStructural formula
Name Furospongin 4
Formula C26H36O5
Mw 428.25627426
CAS RN 41060-11-1
C_ID C00050361 ,
InChIKey CTCIQHXSVBRPQY-STZPRAENSA-N
InChICode InChI=1S/C26H36O5/c1-20(11-6-14-23-17-18-31-19-23)9-5-10-21(2)12-7-15-24(25(27)28)16-8-13-22(3)26(29)30-4/h10-11,13,15,17-19H,5-9,12,14,16H2,1-4H3,(H,27,28)/b20-11+,21-10+,22-13+,24-15-
SMILES COC(=O)/C(C)=C/CC/C(=C/CC/C(C)=C/CC/C(C)=C/CCc1ccoc1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Spongia officinalis Ref.
zoom in