input word = C00048713

Metabolite InformationStructural formula
Name Fragilide D
(-)-Fragilide D
Formula C31H41ClO12
Mw 640.22865449
CAS RN 1030372-27-0
C_ID C00048713 ,
InChIKey CFWWBCJAJBSZLG-LDSNATQHNA-N
InChICode InChI=1S/C31H41ClO12/c1-15(2)12-22(35)39-13-23(36)43-20-9-8-16(3)24(32)26-31(38,17(4)28(37)44-26)27(42-19(6)34)25-29(20,7)21(41-18(5)33)10-11-30(25)14-40-30/h8-9,15,17,20-21,24-27,38H,3,10-14H2,1-2,4-7H3/b9-8+/t17-,20-,21-,24-,25+,26-,27-,29-,30-,31-/m0/s1
SMILES C=C1/C=C/[C@H](OC(=O)COC(=O)CC(C)C)[C@@]2(C)[C@@H](OC(C)=O)CC[C@]3(CO3)[C@@H]2[C@H](OC(C)=O)C2(O)[C@@H](C)C(=O)O[C@H]2[C@H]1Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Junceella fragilis Ref.
zoom in



OrganismJunceella fragilis
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165