input word = C00056193

Metabolite InformationStructural formula
Name Triptergulide D
Formula C20H28O9
Mw 412.17333249
CAS RN 1661001-12-2
C_ID C00056193
InChIKey AKWQMPYEQMQPBY-JWZDBOPLSA-N
InChICode InChI=1S/C20H28O9/c1-16(2,25)18(26)12(21)13(22)20(27)17(3)5-4-8-9(7-28-14(8)23)10(17)6-11-19(20,29-11)15(18)24/h10-13,15,21-22,24-27H,4-7H2,1-3H3/t10-,11-,12+,13+,15+,17-,18-,19+,20+/m0/s1
SMILES CC(C)(O)[C@]1(O)[C@H](O)[C@@H](O)[C@]2(O)[C@]3(O[C@H]3C[C@H]3C4=C(CC[C@@]32C)C(=O)OC4)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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