input word = C00023649

Metabolite InformationStructural formula
Name Allofusicoccin
Formula C36H56O12
Mw 680.37717725
CAS RN 38179-95-2
C_ID C00023649 ,
InChIKey VIDHLMDVVXUKKF-ZOFAOMGKNA-N
InChICode InChI=1S/C36H56O12/c1-10-36(7,8)45-16-26-31(41)32(42)34(46-21(6)38)35(47-26)48-33-29-24(17(2)14-44-20(5)37)13-25(39)28(29)19(4)27-22(15-43-9)11-12-23(27)18(3)30(33)40/h10,17-18,22-23,25-26,28,30-35,39-42H,1,11-16H2,2-9H3/b27-19-/t17-,18+,22+,23-,25-,26+,28-,30+,31+,32-,33+,34+,35+/m0/s1
SMILES C=CC(C)(C)OCC1O[C@H](O[C@@H]2C3=C(C(C)COC(C)=O)C[C@H](O)[C@@H]3/C(C)=C3/[C@@H](COC)CC[C@H]3[C@@H](C)[C@H]2O)C(OC(C)=O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaeFusicoccum amygdali Ref.
zoom in