input word = C00045497

Metabolite InformationStructural formula
Name (6R,9R)-3-Oxo-alpha-ionyl-9-O-beta-glucopyranoside
(+)-(6R,9R)-3-Oxo-alpha-ionyl-9-O-beta-glucopyranoside
Formula C19H30O7
Mw 370.19915331
CAS RN 77699-19-5
C_ID C00045497 ,
InChIKey SZOPSAFLRCYJCX-STCMAXMFNA-N
InChICode InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h5-7,11,13-18,20,22-24H,8-9H2,1-4H3/b6-5+/t11-,13+,14-,15+,16+,17-,18-/m1/s1
SMILES C1C(=O)C=C([C@@H](C1(C)C)/C=C/[C@H](O[C@H]1[C@H](O)[C@H]([C@H]([C@H](O1)CO)O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga tanarius Ref.
PlantaeLabiataeSalvia officinalis Ref.
PlantaeRosaceaeEriobotrya japonica Ref.
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