input word = C00004302

Metabolite InformationStructural formula
Name Luteolin 3',4'-digalacturonide
Formula C27H26O18
Mw 638.11191403
CAS RN 56317-14-7
C_ID C00004302 ,
InChIKey ICPYZSUYRCEHSC-QGZOWJCWNA-N
InChICode InChI=1S/C27H26O18/c28-8-4-9(29)15-10(30)6-12(41-14(15)5-8)7-1-2-11(42-26-20(35)16(31)18(33)22(44-26)24(37)38)13(3-7)43-27-21(36)17(32)19(34)23(45-27)25(39)40/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17+,18-,19-,20-,21-,22-,23-,26-,27-/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(c(c1)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C(=O)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C(=O)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMarchantiaceaeMarchantia berteroana Ref.
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