input word = C00046554

Metabolite InformationStructural formula
Name 12-epi-Montanin B
Formula C19H24O5
Mw 332.16237388
CAS RN 281655-15-0
C_ID C00046554 ,
InChIKey NQFQJZXPCAHOPD-CMMUZJTENA-N
InChICode InChI=1S/C19H24O5/c1-11-7-15(21)17-12(9-20)3-2-4-14(17)19(11)8-16(24-18(19)22)13-5-6-23-10-13/h5-6,10-11,14-16,20-21H,2-4,7-9H2,1H3/t11-,14+,15-,16-,19-/m1/s1
SMILES C1CC(=C2[C@H](C1)[C@]1([C@@H](C[C@H]2O)C)C[C@@H](OC1=O)c1cocc1)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeTeucrium maghrebinum Ref.
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