input word = C00024697

Metabolite InformationStructural formula
Name Chrestifoline C
Formula C37H36N2O2
Mw 540.27767841
CAS RN 129748-52-3
C_ID C00024697 ,
InChIKey WZDZCOAWFXDCTD-UHFFFAOYNA-N
InChICode InChI=1S/C37H36N2O2/c1-23(2)11-10-17-37(4)18-16-28-35-30(19-24(3)36(28)41-37)27-13-7-9-15-32(27)39(35)22-25-20-29-26-12-6-8-14-31(26)38-34(29)33(21-25)40-5/h6-9,11-16,18-21,38H,10,17,22H2,1-5H3/t37-/m1/s1
SMILES c1c(cc2c(c1OC)[nH]c1c2cccc1)Cn1c2c(cc(c3c2C=C[C@](O3)(CCC=C(C)C)C)C)c2c1cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya euchrestifolia Ref.
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