input word = C00056249

Metabolite InformationStructural formula
Name Tripterygiumine V
Formula C43H49NO19
Mw 883.28987839
CAS RN 2016024-51-2
C_ID C00056249
InChIKey KPIAOVGAHMZCMF-UHFFFAOYSA-N
InChICode InChI=1S/C43H49NO19/c1-21(45)55-20-42-34(59-24(4)48)30(50)33-41(8,54)43(42)32(58-23(3)47)29(31(57-22(2)46)35(42)60-25(5)49)40(7,63-43)19-56-37(52)27-15-12-18-44-28(27)16-17-39(6,38(53)61-33)62-36(51)26-13-10-9-11-14-26/h9-15,18,29-35,50,54H,16-17,19-20H2,1-8H3
SMILES CC(=O)OCC12C(OC(C)=O)C(O)C3OC(=O)C(C)(OC(=O)c4ccccc4)CCc4ncccc4C(=O)OCC4(C)OC1([C@@H](OC(C)=O)C4C(OC(C)=O)C2OC(C)=O)C3(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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