input word = C00056210

Metabolite InformationStructural formula
Name Triptersinine Q
Formula C35H41NO13
Mw 683.25779041
CAS RN 1782099-61-9
C_ID C00056210
InChIKey JWCWXUUGSIRKDT-ALUJAXROSA-N
InChICode InChI=1S/C35H41NO13/c1-8-19(2)29(39)48-28-26(47-30(40)22-10-9-14-36-16-22)25-27(45-21(4)38)35(49-32(25,5)6)33(7,42)13-11-24(34(28,35)18-44-20(3)37)46-31(41)23-12-15-43-17-23/h8-10,12,14-17,24-28,42H,11,13,18H2,1-7H3/b19-8+/t24-,25+,26+,27+,28+,33-,34-,35-/m0/s1
SMILES C/C=C(C)C(=O)O[C@@H]1[C@H](OC(=O)c2cccnc2)[C@@H]2[C@@H](OC(C)=O)[C@@]3(OC2(C)C)[C@@]1(COC(C)=O)[C@@H](OC(=O)c1ccoc1)CC[C@]3(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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