input word = C00053292

Metabolite InformationStructural formula
Name Hainangranatumin D
Formula C29H36O10
Mw 544.23084737
CAS RN 1248571-20-1
C_ID C00053292
InChIKey DWHSAQOWBFYRLW-YHYKBWRBSA-N
InChICode InChI=1S/C29H36O10/c1-15-19(11-22(32)36-6)27(3,4)13-18(24(15)34)26(38-16(2)30)29(35)20-12-23(33)39-25(17-8-10-37-14-17)28(20,5)9-7-21(29)31/h8,10,13-15,19-20,25-26,35H,7,9,11-12H2,1-6H3/t15-,19-,20-,25+,26-,28-,29+/m1/s1
SMILES COC(C[C@@H](C(C)(C)C=C1[C@@H](OC(C)=O)[C@]2(O)[C@@](CC(O[C@H]3C4=COC=C4)=O)([H])[C@@]3(C)CCC2=O)[C@@H](C)C1=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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