input word = C00056240

Metabolite InformationStructural formula
Name Tripterygiumine L
Formula C40H46N2O17
Mw 826.27964806
CAS RN 1616264-69-7
C_ID C00056240
InChIKey LHWSATPSZQTFQR-UHFFFAOYSA-N
InChICode InChI=1S/C40H46N2O17/c1-18-19(2)34(48)57-31-29(55-22(5)45)33(58-35(49)24-11-9-13-41-15-24)39(17-52-20(3)43)32(56-23(6)46)28(54-21(4)44)26-30(47)40(39,38(31,8)51)59-37(26,7)16-53-36(50)25-12-10-14-42-27(18)25/h9-15,18-19,26,28-33,47,51H,16-17H2,1-8H3
SMILES CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(=O)c1cccnc1)C4(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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