input word = C00050522

Metabolite InformationStructural formula
Name 5-Deoxyabyssinin II
Formula C21H22O5
Mw 354.14672381
CAS RN 943228-19-1
C_ID C00050522
InChIKey GZTDFKLABHOHBU-SFHVURJKSA-N
InChICode InChI=1S/C21H22O5/c1-12(2)4-5-13-8-14(9-20(25-3)21(13)24)18-11-17(23)16-7-6-15(22)10-19(16)26-18/h4,6-10,18,22,24H,5,11H2,1-3H3/t18-/m0/s1
SMILES COc1cc([C@@H]2CC(=O)c3ccc(O)cc3O2)cc(CC=C(C)C)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeErythrina abyssinica Ref.
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