input word = C00024225

Metabolite InformationStructural formula
Name (+)-Neoacrimarine-G
Formula C29H25NO8
Mw 515.15801678
CAS RN 195057-37-5
C_ID C00024225 ,
InChIKey MNOCITGIWBOSNH-LEFKRGDZNA-N
InChICode InChI=1S/C29H25NO8/c1-29(2)28(34)27(23-19(38-29)10-8-14-9-11-21(32)37-26(14)23)36-20-7-5-6-16-24(20)30(3)17-12-15(35-4)13-18(31)22(17)25(16)33/h5-13,27-28,31,34H,1-4H3/t27-,28-/m0/s1
SMILES c12c(c(cc(c1)OC)O)c(=O)c1c(n2C)c(ccc1)O[C@H]1c2c(OC([C@H]1O)(C)C)ccc1c2oc(=O)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus paradisi Ref.
zoom in