input word = C00003202

Metabolite InformationStructural formula
Name Warburganal
Formula C15H22O3
Mw 250.15689457
CAS RN 62994-47-2
C_ID C00003202 ,
InChIKey QGMWDUUHVVLHNP-FJBXCPOZNA-N
InChICode InChI=1S/C15H22O3/c1-13(2)7-4-8-14(3)12(13)6-5-11(9-16)15(14,18)10-17/h5,9-10,12,18H,4,6-8H2,1-3H3/t12-,14-,15+/m0/s1
SMILES C1CC([C@H]2[C@](C1)([C@@](C(=CC2)C=O)(O)C=O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCanellaceaeWarburgia salutaris Ref.
PlantaePolygonaceaePolygonum hydropiper Ref.
PlantaeRubiaceaeAlberta magna Ref.
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OrganismPolygonum hydropiper
ReferenceSun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999)