input word = C00032656

Metabolite InformationStructural formula
Name 4-Epiaglain A
(-)-4-Epiaglain A
Formula C38H44N2O9
Mw 672.30468102
CAS RN 372119-00-1
C_ID C00032656 ,
InChIKey HCNJABPCRMQADU-TYGHSLDZNA-N
InChICode InChI=1S/C38H44N2O9/c1-7-22(2)34(42)39-30-14-11-19-40(30)35(43)33-31(24-12-9-8-10-13-24)38(25-15-17-26(45-4)18-16-25)36(48-23(3)41)37(33,44)32-28(47-6)20-27(46-5)21-29(32)49-38/h8-10,12-13,15-18,20-22,30-31,33,36,44H,7,11,14,19H2,1-6H3,(H,39,42)/t22-,30-,31-,33-,36-,37+,38+/m0/s1
SMILES c12c([C@]3([C@@H]([C@@H]([C@](O1)(c1ccc(cc1)OC)[C@H]3OC(=O)C)c1ccccc1)C(=O)N1[C@@H](CCC1)NC(=O)[C@@H](C)CC)O)c(cc(c2)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia elliptica Ref.
zoom in



OrganismAglaia elliptica
ReferenceInada,Chem.Pharm.Bull.,49,(2001),1226