input word = C00035193

Metabolite InformationStructural formula
Name 10-Hydroxyteucjaponin B
Formula C22H28O8
Mw 420.17841787
CAS RN 869563-63-3
C_ID C00035193 ,
InChIKey DXODNKAZIJJHJD-QIQSIKBWNA-N
InChICode InChI=1S/C22H28O8/c1-13-8-17(24)21(12-28-14(2)23)19(11-29-19)5-3-6-22(21,26)20(13)9-16(30-18(20)25)15-4-7-27-10-15/h4,7,10,13,16-17,24,26H,3,5-6,8-9,11-12H2,1-2H3/t13-,16+,17-,19+,20+,21+,22+/m1/s1
SMILES C1C[C@@]2([C@]3([C@](C1)([C@]1([C@@H](C[C@H]3O)C)C[C@H](OC1=O)c1cocc1)O)COC(=O)C)CO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeTeucrium fruticans L. Ref.
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