input word = C00010613

Metabolite InformationStructural formula
Name Mentzeloside
Deutzioside
5-Deoxyscabroside
Formula C15H22O9
Mw 346.1263823
CAS RN 41753-47-3
C_ID C00010613 ,
InChIKey QSOURIMNVDBNHL-TUKNBCJYNA-N
InChICode InChI=1S/C15H22O9/c1-4-3-21-14(7-6(4)9(18)13-12(7)23-13)24-15-11(20)10(19)8(17)5(2-16)22-15/h3,5-20H,2H2,1H3/t5-,6+,7-,8-,9-,10+,11-,12+,13-,14-,15-/m0/s1
SMILES [C@H]12[C@H]([C@@H](OC=C1C)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO)[C@@H]1[C@H]([C@H]2O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHydrangeaceaeDeutzia scabra Thunb. Ref.
PlantaeLoasaceaeMentzelia decapetala Ref.
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