input word = C00008386

Metabolite InformationStructural formula
Name Narirutin 4'-glucoside
Formula C33H42O19
Mw 742.23202916
CAS RN 17257-22-6
C_ID C00008386 ,
InChIKey KQUWJUNIYQVHCG-SXFMELFENA-N
InChICode InChI=1S/C33H42O19/c1-11-22(37)25(40)28(43)31(47-11)46-10-20-24(39)27(42)30(45)33(52-20)49-14-6-15(35)21-16(36)8-17(50-18(21)7-14)12-2-4-13(5-3-12)48-32-29(44)26(41)23(38)19(9-34)51-32/h2-7,11,17,19-20,22-35,37-45H,8-10H2,1H3/t11-,17-,19+,20+,22-,23+,24+,25-,26+,27-,28+,29-,30+,31+,32+,33+/m0/s1
SMILES c1(cc(c2c(c1)O[C@@H](CC2=O)c1ccc(cc1)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus spp. Ref.
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OrganismCitrus spp.
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 500,Flavanones and dihydroflavonols

Mizelle,Phytochem.,6,(1967),1305