input word = C00044373

Metabolite InformationStructural formula
Name Venezinone
Formula C37H68O6
Mw 608.5015899
CAS RN 212709-83-6
C_ID C00044373 ,
InChIKey XVKNYGYWPNIGLQ-PFONDFGANA-N
InChICode InChI=1S/C37H68O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-35(40)36(41)28-23-17-16-19-24-33(39)25-20-18-21-26-34-30-32(29-31(2)38)37(42)43-34/h14-15,32-36,39-41H,3-13,16-30H2,1-2H3/b15-14-/t32-,33+,34+,35+,36-/m0/s1
SMILES C1[C@H](OC(=O)[C@H]1CC(=O)C)CCCCC[C@H](O)CCCCCC[C@H](O)[C@H](O)CC/C=C\CCCCCCCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeXylopia aromatica Ref.
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OrganismXylopia aromatica
ReferenceZafra-Polo,Phytochem.,48,(1998),1087