input word = C00048924

Metabolite InformationStructural formula
Name Xylogranatin R
(+)-Xylogranatin R
Formula C27H32O9
Mw 500.20463262
CAS RN 1033090-51-5
C_ID C00048924 ,
InChIKey IYEWDOOFXNMWEJ-NFOJXOPYNA-N
InChICode InChI=1S/C27H32O9/c1-15-18(11-22(31)34-5)26(2,3)13-17(24(15)33)10-20(28)19-12-23(32)36-25(16-7-9-35-14-16)27(19,4)8-6-21(29)30/h7,9,12-15,18,25H,6,8,10-11H2,1-5H3,(H,29,30)/t15-,18-,25+,27-/m1/s1
SMILES C1(=CC(=O)O[C@H]([C@@]1(CCC(=O)O)C)c1cocc1)C(=O)CC1=CC([C@@H]([C@H](C1=O)C)CC(=O)OC)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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