input word = C00002594

Metabolite InformationStructural formula
Name 4'-Demethyldeoxypodophyllotoxin
4'-Demethyldesoxypodophyllotoxin
Formula C21H20O7
Mw 384.12090299
CAS RN 3590-93-0
C_ID C00002594 ,
InChIKey RFDMNXDDRXVJTM-MJUJRNRDNA-N
InChICode InChI=1S/C21H20O7/c1-24-16-5-11(6-17(25-2)20(16)22)18-13-7-15-14(27-9-28-15)4-10(13)3-12-8-26-21(23)19(12)18/h4-7,12,18-19,22H,3,8-9H2,1-2H3/t12-,18+,19-/m0/s1
SMILES c12c(cc3c(c1)OCO3)C[C@@H]1[C@@H]([C@@H]2c2cc(c(c(c2)OC)O)OC)C(=O)OC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaePodophyllum hexandrum Ref.
PlantaeBerberidaceaePodophyllum peltatum Ref.
PlantaeBerberidaceaeSinopodophyllum emodi Ref.
PlantaeLabiataeHyptis verticillata Ref.
PlantaePolygalaceaePolygala macradenia Ref.
PlantaePolygalaceaePolygala paena Ref.
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OrganismPolygala paena
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter39