input word = C00037800

Metabolite InformationStructural formula
Name Secologanoside
Formula C16H22O11
Mw 390.11621155
CAS RN 59472-23-0
C_ID C00037800 ,
InChIKey RGTONEMDTVVDMY-WZTZUDLJNA-N
InChICode InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)/t6-,7+,9-,11-,12+,13-,15+,16+/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)O[C@H]1[C@@H]([C@@H](C(=CO1)C(=O)O)CC(=O)O)C=C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaprifoliaceae/Diervillaceae/Dipsacaceae/Linnaeaceae/ValerianaceaeLonicera japonica Ref.
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium lamarckii Ref.
PlantaeGentianaceaeGentiana rhodantha Ref.
PlantaeLonganiaceaeStrychnos spinosa Ref.
PlantaeOleaceaeFontanesia fortunei Carr. Ref.
PlantaeOleaceaeFontanesia phillyreoides Labill. Ref.
PlantaeOleaceaeFraxinus chinensis Roxb. Ref.
PlantaeOleaceaeLigustrum ovalifolium Hassk. Ref.
PlantaeOleaceaeMenodora robusta (Benth.) A.Gray Ref.
PlantaeOleaceaeOlea europaea L. Ref.
PlantaeOleaceaeOsmanthus austrocaledonicus (Vieill.) Knobl. Ref.
PlantaeOleaceaeOsmanthus fragrans (Thunb.) Lour. Ref.
PlantaeOleaceaePhillyrea latifolia L. Ref.
PlantaeOleaceaePicconia excelsa (Aiton) DC. Ref.
PlantaeOleaceaeSyringa josikaea Jacq. f. Ref.
PlantaeOleaceaeSyringa vulgaris L. Ref.
PlantaeRubiaceaeAdina racemosa Ref.
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