input word = C00024089

Metabolite InformationStructural formula
Name 6alpha-Acetoxy-5-epilimonin
6-Epiglaucin B
Formula C28H32O10
Mw 528.19954724
CAS RN 115458-72-5
C_ID C00024089 ,
InChIKey IHOHGVDNDQTZGL-VJBNROFYNA-N
InChICode InChI=1S/C28H32O10/c1-13(29)35-18-19-24(2,3)37-16-10-17(30)34-12-27(16,19)15-6-8-25(4)21(14-7-9-33-11-14)36-23(32)22-28(25,38-22)26(15,5)20(18)31/h7,9,11,15-16,18-19,21-22H,6,8,10,12H2,1-5H3/t15-,16+,18-,19-,21+,22-,25+,26+,27+,28-/m1/s1
SMILES CC(=O)O[C@H]1C(=O)[C@]2(C)[C@H](CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]432)[C@@]23COC(=O)CC[C@@H]2OC(C)(C)[C@@H]13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeEvodia rutaecarpa BENTHAM Ref.
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OrganismEvodia rutaecarpa BENTHAM
ReferenceSugimoto,Chem.Pharm.Bull.,36,(1988),1237-1240