input word = C00033282

Metabolite InformationStructural formula
Name Pabulenol
Formula C16H14O5
Mw 286.08412356
CAS RN 33889-70-2
C_ID C00033282 ,
InChIKey BVMOMQJYQYBMKL-STGVRZAANA-N
InChICode InChI=1S/C16H14O5/c1-9(2)12(17)8-20-16-10-3-4-15(18)21-14(10)7-13-11(16)5-6-19-13/h3-7,12,17H,1,8H2,2H3/t12-/m1/s1
SMILES C=C(C)[C@H](O)COc1c2ccoc2cc2oc(=O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica dahurica Ref.
PlantaeApiaceaeFerula sumbul Ref.
PlantaeApiaceaeNiphogeton ternata Ref.
PlantaeRutaceaeRuta graveolens Ref.
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OrganismRuta graveolens
ReferenceYin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).

Edited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979).

DUAN, et al., Chem Pharm Bull, 50, (2002), 115.

Stavri, et al., Planta Med, 69, (2003), 956