input word = C00024266

Metabolite InformationStructural formula
Name Neoacrimarine-K
Formula C31H29NO9
Mw 559.18423153
CAS RN 217199-09-2
C_ID C00024266 ,
InChIKey XRRKNHPPSZSNHE-VZOBPTPFNA-N
InChICode InChI=1S/C31H29NO9/c1-31(2,36)30-24(23-17(40-30)10-7-14-8-12-20(34)41-28(14)23)22-19(38-5)13-16(33)21-26(22)32(3)25-15(27(21)35)9-11-18(37-4)29(25)39-6/h7-13,24,30,33,36H,1-6H3/t24-,30-/m0/s1
SMILES COc1ccc2c(=O)c3c(O)cc(OC)c([C@H]4c5c(ccc6ccc(=O)oc56)O[C@@H]4C(C)(C)O)c3n(C)c2c1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus paradisi Ref.
zoom in