input word = C00035716

Metabolite InformationStructural formula
Name Otostegin B
(-)-Otostegin B
Formula C22H34O6
Mw 394.23553882
CAS RN 308328-57-6
C_ID C00035716 ,
InChIKey WYYAQYOZQLIYRP-UFRZKHJHNA-N
InChICode InChI=1S/C22H34O6/c1-13-16(25)17(27-14(2)23)18-19(3,4)7-6-8-20(18,5)22(13)10-9-21(28-22)11-15(24)26-12-21/h13,15,17-18,24H,6-12H2,1-5H3/t13-,15-,17-,18+,20+,21-,22-/m1/s1
SMILES C1CC([C@H]2[C@](C1)([C@]1([C@@H](C(=O)[C@H]2OC(=O)C)C)CC[C@@]2(O1)C[C@@H](OC2)O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeOtostegia fruticosa Ref.
PlantaeLabiataeOtostegia integrifolia Ref.
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OrganismOtostegia fruticosa
ReferenceAl-Musayeib,Phytochem.,54,(2000),771