input word = C00046065

Metabolite InformationStructural formula
Name Koetjapic acid
Formula C30H46O4
Mw 470.33960996
CAS RN 142905-27-9
C_ID C00046065 ,
InChIKey ASOUKQDZWGOCBR-HDZILRTCNA-N
InChICode InChI=1S/C30H46O4/c1-19(2)20-10-13-30(7)23(28(20,5)12-11-24(31)32)9-8-21-22-18-27(4,25(33)34)15-14-26(22,3)16-17-29(21,30)6/h8,20,22-23H,1,9-18H2,2-7H3,(H,31,32)(H,33,34)/t20-,22-,23+,26+,27-,28+,29+,30+/m0/s1
SMILES C=C(C)[C@@H]1CC[C@]2(C)[C@H](CC=C3[C@@H]4C[C@@](C)(C(=O)O)CC[C@]4(C)CC[C@]32C)[C@@]1(C)CCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeMaytenus undata Ref.
PlantaeDilleniaceaeDillenia serrata Ref.
PlantaeMeliaceaeSandoricum indicum Ref.
PlantaeMeliaceaeSandoricum koetjape Ref.
zoom in



OrganismDillenia serrata
ReferenceJalil, J. et al., Molecules, 20, (2015), 3206-3220.