input word = C00036237

Metabolite InformationStructural formula
Name Veprisone
Formula C27H34O8
Mw 486.22536806
CAS RN 2494-62-4
C_ID C00036237 ,
InChIKey PIMHETLTQXNYHC-UHFFFAOYNA-N
InChICode InChI=1S/C27H34O8/c1-23(2)16-11-17(28)26(5)15(25(16,4)18(34-23)12-19(29)31-6)7-9-24(3)20(14-8-10-32-13-14)33-22(30)21-27(24,26)35-21/h8,10,13,15-16,18,20-21H,7,9,11-12H2,1-6H3/t15-,16+,18-,20-,21-,24+,25-,26+,27-/m1/s1
SMILES C1(=O)O[C@@H]([C@]2([C@]3([C@@H]1O3)[C@]1([C@H](CC2)[C@@]2([C@@H](CC1=O)C(O[C@@H]2CC(=O)OC)(C)C)C)C)C)c1cocc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeBouchardatia neurococca Ref.
PlantaeRutaceaeVepris bilocularis Ref.
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