input word = C00036663

Metabolite InformationStructural formula
Name 8-epi-Deoxyloganic acid
8-Epideoxyloganic acid
Epideoxyloganic acid
Formula C16H24O9
Mw 360.14203237
CAS RN 88668-99-9
C_ID C00036663 ,
InChIKey DSXFHNSGLYXPNG-KYAHAFDNNA-N
InChICode InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1
SMILES C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeIncarvillea delavayi Ref.
PlantaePlantaginaceaePlantago webbii Ref.
PlantaeScrophulariaceaeRehmannia glutinosa Ref.
PlantaeScrophulariaceaeScrophularia dentata Ref.
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OrganismScrophularia dentata
ReferenceSingh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA.