input word = C00050099

Metabolite InformationStructural formula
Name Flexibilolide
(-)-Flexibilolide
Formula C20H32O5
Mw 352.22497413
CAS RN 184362-79-6
C_ID C00050099 ,
InChIKey VSACXHNBFLZWMF-ORKXLOCUNA-N
InChICode InChI=1S/C20H32O5/c1-13-6-7-15-12-17(25-18(22)14(15)2)20(4,24)10-5-9-19(3,23)11-8-16(13)21/h6,15-17,21,23-24H,2,5,7-12H2,1,3-4H3/b13-6-/t15-,16+,17+,19-,20+/m1/s1
SMILES C\1(=C\C[C@@H]2C[C@@H]([C@@](CCC[C@@](CC[C@@H]1O)(C)O)(C)O)OC(=O)C2=C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia flexibilis Ref.
zoom in