input word = C00059488

Metabolite InformationStructural formula
Name Hainangranatumin J
Formula C31H38O10
Mw 570.24649744
CAS RN 1248571-26-7
C_ID C00059488
InChIKey JKUPBJJCACXSMM-ASXDRAADSA-N
InChICode InChI=1S/C31H38O10/c1-16(2)28(36)41-27(19-14-29(4,5)20(12-22(32)38-7)17(3)24(19)34)31(37)10-9-30(6)21(25(31)35)13-23(33)40-26(30)18-8-11-39-15-18/h8,11,13-17,20,26-27,37H,9-10,12H2,1-7H3/t17-,20-,26+,27-,30-,31-/m1/s1
SMILES COC(=O)CC1C(C)C(=O)C(C(OC(=O)C(C)C)C2(O)CCC3(C)C(=CC(=O)OC3c3ccoc3)C2=O)=CC1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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