input word = C00035465

Metabolite InformationStructural formula
Name 15-epi-Otostegin B
Formula C22H34O6
Mw 394.23553882
CAS RN 308106-29-8
C_ID C00035465 ,
InChIKey WYYAQYOZQLIYRP-PCYADIMRNA-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 CC(=O)O[C@@H]1C(=O)[C@@H](C)[C@]2(CC[C@@]3(CO[C@H](O)C3)O2)[C@@]2(C)CCCC(C)(C)[C@H]12
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