input word = C00010645

Metabolite InformationStructural formula
Name Patrinoside
Formula C21H34O11
Mw 462.21011193
CAS RN 53962-20-2
C_ID C00010645 ,
InChIKey BGDMXWQJUGENQP-PORVFJNSNA-N
InChICode InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14+,16-,17-,18-,19+,20+,21-/m1/s1
SMILES [C@H]12[C@@H]([C@@H](OC=C1CO[C@@H]1O[C@H]([C@H]([C@H]([C@@H]1O)O)O)CO)OC(=O)CC(C)C)[C@H]([C@H](C2)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaprifoliaceaePatrinia saniculaefolia Ref.
PlantaeCaprifoliaceaePatrinia scabiosaefolia Ref.
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeCentranthus longiflorus ssp. longiflorus Ref.
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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