input word = C00056204

Metabolite InformationStructural formula
Name Triptersinine K
Formula C31H36O14
Mw 632.21050586
CAS RN 1416246-54-2
C_ID C00056204
InChIKey KTFFOTYEMQOLKB-HQRXZHMLSA-N
InChICode InChI=1S/C31H36O14/c1-16(32)40-15-30-21(43-26(35)19-8-11-38-13-19)7-10-29(6,37)31(30)24(42-18(3)34)22(28(4,5)45-31)23(41-17(2)33)25(30)44-27(36)20-9-12-39-14-20/h8-9,11-14,21-25,37H,7,10,15H2,1-6H3/t21-,22+,23+,24+,25+,29-,30-,31-/m0/s1
SMILES CC(=O)OC[C@@]12[C@@H](OC(=O)c3ccoc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccoc1)[C@H]3OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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