input word = C00057621

Metabolite InformationStructural formula
Name Orizanorditerpenyl benzoate
Formula C26H44O3
Mw 404.32904527
CAS RN 873685-25-7
C_ID C00057621
InChIKey KWMDECCDBHDQSM-FVEXOFTDSA-N
InChICode InChI=1S/C26H44O3/c1-5-6-8-14-23(4)25(27)18-17-21(2)12-11-13-22(3)19-20-29-26(28)24-15-9-7-10-16-24/h7,9-10,15-16,21-23,25,27H,5-6,8,11-14,17-20H2,1-4H3/t21-,22+,23+,25+/m1/s1
SMILES CCCCC[C@H](C)[C@@H](O)CC[C@H](C)CCC[C@H](C)CCOC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeOryza sativa Ref.
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OrganismOryza sativa
ReferenceChung, I.M. et al., Chem. Nat. Compd. (Engl. Transl.), 2005, 41, 182-189