input word = C00064204

Metabolite InformationStructural formula
Name Homovanillic alcohol
Formula C9H12O3
Mw 168.07864425
CAS RN 2380-78-1
C_ID C00064204
InChIKey XHUBSJRBOQIZNI-UHFFFAOYSA-N
InChICode InChI=1S/C9H12O3/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,10-11H,4-5H2,1H3
SMILES COc1cc(CCO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeScrophulariaceaeScrophularia ningpoensis Ref.
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OrganismScrophularia ningpoensis
ReferenceSingh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA.