input word = C00005497

Metabolite InformationStructural formula
Name Quercetin 3-methyl ether 7-rhamnoside-3'-xyloside
Formula C27H30O15
Mw 594.15847029
CAS RN 93373-13-8
C_ID C00005497 ,
InChIKey CIAVRKZNFRMUNY-VRVCCGBLNA-N
InChICode InChI=1S/C27H30O15/c1-9-18(31)21(34)23(36)27(39-9)40-11-6-13(29)17-16(7-11)41-24(25(37-2)20(17)33)10-3-4-12(28)15(5-10)42-26-22(35)19(32)14(30)8-38-26/h3-7,9,14,18-19,21-23,26-32,34-36H,8H2,1-2H3/t9-,14-,18-,19-,21-,22-,23+,26-,27-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)OC)c1ccc(c(c1)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePodocarpaceaeDacrycarpus dacrydioides Ref.
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