input word = C00023549

Metabolite InformationStructural formula
Name Montanin G
Formula C24H30O9
Mw 462.18898256
CAS RN 107090-88-0
C_ID C00023549 ,
InChIKey XWQPBOZEAVXNBB-NIIZWVICNA-N
InChICode InChI=1S/C24H30O9/c1-13-8-20(32-15(3)26)23(11-30-14(2)25)18(4-5-19(27)24(23)12-31-24)22(13)9-17(33-21(22)28)16-6-7-29-10-16/h6-7,10,13,17-20,27H,4-5,8-9,11-12H2,1-3H3/t13-,17-,18-,19+,20+,22-,23+,24-/m1/s1
SMILES CC(=O)OC[C@@]12[C@@H](OC(C)=O)C[C@@H](C)[C@]3(C[C@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](O)[C@]21CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeTeucrium montanum Ref.
PlantaeLabiataeTeucrium montbretii ssp. libanoticum Ref.
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