input word = C00056191

Metabolite InformationStructural formula
Name Triptergulide B
Formula C20H24O8
Mw 392.14711774
CAS RN 1661001-00-8
C_ID C00056191
InChIKey WOFOIXABIDDALE-JPIISKGFSA-N
InChICode InChI=1S/C20H24O8/c1-16(2,23)19-13-12(21)20(25)17(3)5-4-8-9(7-26-14(8)22)10(17)6-11(27-13)18(20,24)15(19)28-19/h10-11,13,15,23-25H,4-7H2,1-3H3/t10-,11+,13-,15+,17-,18+,19-,20+/m0/s1
SMILES CC(C)(O)[C@@]12O[C@@H]1[C@]1(O)[C@H]3C[C@H]4C5=C(CC[C@]4(C)[C@]1(O)C(=O)[C@@H]2O3)C(=O)OC5
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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OrganismTripterygium wilfordii
ReferenceLv, H. et al., Fitoterapia, 137, (2019), 104190.