input word = C00008845

Metabolite InformationStructural formula
Name Catechin 5-O-beta-D-apiofuranoside
Formula C20H22O10
Mw 422.12129692
CAS RN 125322-89-6
C_ID C00008845 ,
InChIKey CQLVDGMTYYDVHM-SRTCBVFPNA-N
InChICode InChI=1S/C20H22O10/c21-7-20(27)8-28-19(18(20)26)30-16-5-10(22)4-15-11(16)6-14(25)17(29-15)9-1-2-12(23)13(24)3-9/h1-5,14,17-19,21-27H,6-8H2/t14-,17+,18-,19-,20-/m0/s1
SMILES OC[C@]1(O)CO[C@@H](Oc2cc(O)cc3c2C[C@H](O)[C@@H](c2ccc(O)c(O)c2)O3)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeUlmaceaeUlmus davidiana Ref.
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