input word = C00057007

Metabolite InformationStructural formula
Name 23,24,25,26,27-Pentanor-3,7-dioxocucurbit-5-en-22-oic acid
Formula C25H36O4
Mw 400.26135964
CAS RN 1289117-58-3
C_ID C00057007
InChIKey NESUTGXPHDNOHE-GYCVRCNYSA-N
InChICode InChI=1S/C25H36O4/c1-14(21(28)29)15-9-11-23(4)16(15)10-12-24(5)17-7-8-19(26)22(2,3)18(17)13-20(27)25(23,24)6/h13-17H,7-12H2,1-6H3,(H,28,29)/t14-,15+,16+,17+,23+,24-,25-/m0/s1
SMILES C[C@H](C(=O)O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@]1(C)[C@@H]3CCC(=O)C(C)(C)C3=CC(=O)[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
zoom in