input word = C00063277

Metabolite InformationStructural formula
Name (+) Catechin hydrate
Formula C15H14O6.H2O
Mw 308.08960287
CAS RN 88191-48-4
C_ID C00063277
InChIKey OFUMQWOJBVNKLR-NQQJLSKUSA-N
InChICode InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1;InChI=1S/C15H14O6.H2O/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-5,13,15-20H,6H2;1H2/t13-,15+;/m0./s1
SMILES O.Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllalesBeta vulgaris Ref.
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OrganismBeta vulgaris
Referencehttps://doi.org/10.1007/s11130-010-0156-6