input word = C00061543

Metabolite InformationStructural formula
Name (-)-3-Demethylisolariciresinol
Formula C19H22O6
Mw 346.14163844
CAS RN 349150-66-9
C_ID C00061543
InChIKey PGDXMXMJDYPCRB-PJFSTRORSA-N
InChICode InChI=1S/C19H22O6/c1-25-18-6-10(2-3-15(18)22)19-13-7-17(24)16(23)5-11(13)4-12(8-20)14(19)9-21/h2-3,5-7,12,14,19-24H,4,8-9H2,1H3/t12-,14-,19-/m0/s1;InChI=1S/C19H22O6/c1-25-18-6-10(2-3-15(18)22)19-13-7-17(24)16(23)5-11(13)4-12(8-20)14(19)9-21/h2-3,5-7,12,14,19-24H,4,8-9H2,1H3/t12-,14-,19-/m1/s1;InChI=1S/C19H22O6/c1-25-18-6-10(2-3-15(18)22)19-13-7-17(24)16(23)5-11(13)4-12(8-20)14(19)9-21/h2-3,5-7,12,14,19-24H,4,8-9H2,1H3
SMILES COc1cc(C2c3cc(O)c(O)cc3CC(CO)C2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus baccata Ref.
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