input word = C00053517

Metabolite InformationStructural formula
Name Muridienin 3
Formula C37H66O2
Mw 542.50628135
CAS RN 206131-78-4
C_ID C00053517
InChIKey YNPRPJJXZAYRPA-MROWCJNISA-N
InChICode InChI=1S/C37H66O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-36-34-35(2)39-37(36)38/h18-19,22-23,34-35H,3-17,20-21,24-33H2,1-2H3/b19-18-,23-22-/t35-/m0/s1
SMILES CCCCCCCCCCCCCCCC/C=CCC/C=CCCCCCCCCCCC1=C[C@H](C)OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
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OrganismAnnona muricata
ReferenceZorofchian, S. et al., Int. J. Mol. Sci., 16, (2015), 15625-15658.