input word = C00042164

Metabolite InformationStructural formula
Name 6-O-Benzoylsucrose
Formula C19H26O12
Mw 446.1424263
CAS RN 127924-16-7
C_ID C00042164 ,
InChIKey AFHCRQREQZIDSI-CLEIJSQXNA-N
InChICode InChI=1S/C19H26O12/c20-6-10-13(23)16(26)19(8-21,30-10)31-18-15(25)14(24)12(22)11(29-18)7-28-17(27)9-4-2-1-3-5-9/h1-5,10-16,18,20-26H,6-8H2/t10-,11-,12-,13-,14+,15-,16+,18-,19+/m1/s1
SMILES O=C(OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala tricornis Ref.
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OrganismPolygala tricornis
ReferenceJiang,J.Nat.Prod.,68,(2005),739