input word = C00008223

Metabolite InformationStructural formula
Name Didymin
Isosakuranetin-7-rutinoside
Formula C28H34O14
Mw 594.1948558
CAS RN 14259-47-3
C_ID C00008223 ,
InChIKey RMCRQBAILCLJGU-USZZWXRFNA-N
InChICode InChI=1S/C28H34O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-29,31-36H,9-10H2,1-2H3/t11-,17-,19+,21-,22+,23-,24-,25+,26+,27+,28+/m0/s1
SMILES c1(cc(c2c(c1)O[C@@H](CC2=O)c1ccc(cc1)OC)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
PlantaeLabiataeMonarda didyma Ref.
PlantaeLabiataeMonarda didyma,Citrus spp. Ref.
PlantaeLamiaceaeAcinos alpinus Ref.
PlantaeRutaceaeCitrus paradisi Ref.
PlantaeRutaceaeCitrus reticulata Ref.
PlantaeRutaceaeCitrus sinensis Ref.
PlantaeRutaceaeCitrus spp. Ref.
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