input word = C00051213

Metabolite InformationStructural formula
Name Lavandulifolioside
Formula C34H44O19
Mw 756.24767923
CAS RN 117895-00-8
C_ID C00051213
InChIKey UDHCHDJLZGYDDM-KWBKPMJUNA-N
InChICode InChI=1S/C34H44O19/c1-14-24(42)26(44)31(53-32-27(45)25(43)21(40)13-48-32)34(49-14)52-30-28(46)33(47-9-8-16-3-6-18(37)20(39)11-16)50-22(12-35)29(30)51-23(41)7-4-15-2-5-17(36)19(38)10-15/h2-7,10-11,14,21-22,24-40,42-46H,8-9,12-13H2,1H3/b7-4-/t14-,21-,22+,24-,25-,26+,27+,28+,29+,30+,31+,32-,33+,34-/m0/s1
SMILES C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@H]2OC(=O)/C=Cc2ccc(O)c(O)c2)[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeStachys sieboldii Ref.
PlantaePlantaginaceaePlantago lanceolata Ref.
PlantaePlantaginaceaeVeronica persica Ref.
--Vernonica persica Ref.
zoom in



OrganismVernonica persica
ReferenceHARPUT, et al., Chem Pharm Bull, 50, (2002), 869.

Budzianowska, et al., Planta Med, 70, (2004), 834