input word = C00059482

Metabolite InformationStructural formula
Name Hainangranatumin C
Formula C30H36O10
Mw 556.23084737
CAS RN 1248571-18-7
C_ID C00059482
InChIKey IGMRBIFWKVCNOA-IUYJXZCKSA-N
InChICode InChI=1S/C30H36O10/c1-7-22(32)39-27(18-14-28(3,4)19(12-23(33)37-6)16(2)25(18)35)30(36)20-13-24(34)40-26(17-9-11-38-15-17)29(20,5)10-8-21(30)31/h9,11,13-16,19,26-27,36H,7-8,10,12H2,1-6H3/t16-,19-,26+,27-,29-,30+/m1/s1
SMILES CCC(=O)OC(C1=CC(C)(C)C(CC(=O)OC)C(C)C1=O)C1(O)C(=O)CCC2(C)C1=CC(=O)OC2c1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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