input word = C00051595

Metabolite InformationStructural formula
Name Mexolide
Formula C32H32O8
Mw 544.209718
CAS RN 77394-21-9
C_ID C00051595
InChIKey CAOMNZCNDRTZRQ-UHFFFAOYNA-N
InChICode InChI=1S/C32H32O8/c1-18-11-13-32(2,14-12-21-24(36-4)16-23(35-3)19-7-9-27(33)39-30(19)21)22(15-18)29-26(38-6)17-25(37-5)20-8-10-28(34)40-31(20)29/h7-10,12,14-17,22H,11,13H2,1-6H3
SMILES COc1cc(OC)c2ccc(=O)oc2c1C=CC1(C)CCC(C)=CC1c1c(OC)cc(OC)c2ccc(=O)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya exotica Ref.
PlantaeRutaceaeMurraya paniculata var.exotica Ref.
PlantaeRutaceaeToddalia asiatica Ref.
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