input word = C00049759

Metabolite InformationStructural formula
Name Triptobenzene N
(-)-Triptobenzene N
Formula C20H26O3
Mw 314.1881947
CAS RN 251340-93-9
C_ID C00049759 ,
InChIKey AILBGNUDAQUSML-NQDYJFDNNA-N
InChICode InChI=1S/C20H26O3/c1-12(2)13-5-6-15-14(9-13)16(22)10-17-19(15,3)8-7-18(23)20(17,4)11-21/h5-6,9,12,17,21H,7-8,10-11H2,1-4H3/t17-,19-,20-/m1/s1
SMILES CC(C)c1ccc2c(c1)C(=O)C[C@H]1[C@@](C)(CO)C(=O)CC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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