input word = C00049787

Metabolite InformationStructural formula
Name Donnaienin
Formula C35H64O8
Mw 612.46011902
CAS RN 198987-63-2
C_ID C00049787 ,
InChIKey JTTZQARJVXNGRN-MQODCZCNNA-N
InChICode InChI=1S/C35H64O8/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-30(38)33-25-32(40)34(43-33)31(39)22-21-28(36)18-15-14-16-19-29(37)24-27-23-26(2)42-35(27)41/h23,26,28-34,36-40H,3-22,24-25H2,1-2H3/t26-,28-,29+,30-,31-,32+,33-,34+/m0/s1
SMILES CCCCCCCCCCCCCC[C@H](O)[C@@H]1C[C@@H](O)[C@@H]([C@@H](O)CC[C@@H](O)CCCCC[C@@H](O)CC2=C[C@H](C)OC2=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeGoniothalamus donnaiensis Ref.
zoom in