input word = C00008530

Metabolite InformationStructural formula
Name Naringin 6''-malonate
Formula C30H34O17
Mw 666.17959966
CAS RN 139934-59-1
C_ID C00008530 ,
InChIKey YCOQCRMFNLZUCL-DWWLEKJZNA-N
InChICode InChI=1S/C30H34O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-7,11,17,19,23-32,37-41H,8-10H2,1H3,(H,34,35)/t11-,17+,19+,23-,24-,25-,26-,27+,28+,29-,30+/m0/s1
SMILES CC1O[C@@H](OC2[C@H](Oc3cc(O)c4c(c3)OC(c3ccc(O)cc3)CC4=O)OC(COC(=O)CC(=O)O)[C@@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus paradisi Ref.
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OrganismCitrus paradisi
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 645,Flavanones and dihydroflavonols

Berhow,Phytochem.,30,(1991),4198