input word = C00047220

Metabolite InformationStructural formula
Name Durumhemiketalolide C
(+)-Durumhemiketalolide C
Formula C22H30O6
Mw 390.20423869
CAS RN 1100359-14-5
C_ID C00047220 ,
InChIKey KMXSIXIXRFATQL-UFJCQUESNA-N
InChICode InChI=1S/C22H30O6/c1-14-7-5-8-15(2)12-22(25)18-11-19(27-20(24)16(18)3)21(28-22,10-6-9-14)13-26-17(4)23/h8-9,18-19,25H,3,5-7,10-13H2,1-2,4H3/b14-9-,15-8+/t18-,19-,21-,22+/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@H]1[C@]1(O)C/C(C)=C/CC/C(C)=CCC[C@]2(COC(C)=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lobophytum durum Ref.
zoom in