input word = C00048955

Metabolite InformationStructural formula
Name Annoreticuin-9-one
Formula C35H62O7
Mw 594.44955433
CAS RN 152369-74-9
C_ID C00048955 ,
InChIKey QCICHLFBIUXRKT-KIKGEMIXNA-N
InChICode InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-14-21-31(38)33-23-24-34(42-33)32(39)22-15-12-13-18-29(36)19-16-17-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,30-34,37-39H,3-24,26H2,1-2H3/t27-,30+,31+,32+,33+,34+/m0/s1
SMILES [C@@H]1(CC[C@@H](O1)[C@@H](CCCCCCCCCCCC)O)[C@@H](CCCCCC(=O)CCCC[C@H](CC1=C[C@@H](OC1=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
PlantaeAnnonaceaeAnnona reticulata Ref.
PlantaeAnnonaceaeAnnona squamosa Ref.
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