input word = C00024224

Metabolite InformationStructural formula
Name (+)-Neoacrimarine-F
Formula C29H25NO9
Mw 531.15293141
CAS RN 195057-36-4
C_ID C00024224 ,
InChIKey VMABFFUJXPHEJX-LEFKRGDZNA-N
InChICode InChI=1S/C29H25NO9/c1-29(2)28(35)27(22-19(39-29)9-5-13-6-10-20(33)37-25(13)22)38-26-17(31)8-7-15-23(26)30(3)16-11-14(36-4)12-18(32)21(16)24(15)34/h5-12,27-28,31-32,35H,1-4H3/t27-,28-/m0/s1
SMILES c12c(c(cc(c1)OC)O)c(=O)c1c(n2C)c(c(cc1)O)O[C@H]1c2c(OC([C@H]1O)(C)C)ccc1c2oc(=O)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate L-Phe
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus hybrid `Yalaha` Ref.
PlantaeRutaceaeCitrus paradisi x Citrus tangerina Ref.
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