input word = C00011174

Metabolite InformationStructural formula
Name Luteolin 7-O-(2-apiofuranosyl-4-glucopyranosyl-6-malonyl)glucopyranoside
7-[[O-D-apio-beta-D-furanosyl-(1->2)-O-[beta-D-glucopyranosyl-(1->4)]-6-O-(carboxyacetyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-1-benzopyran-4-one
Formula C35H40O23
Mw 828.19603759
CAS RN 612844-31-2
C_ID C00011174 ,
InChIKey UAGBVLJNVRPERW-WLJBCVAGNA-N
InChICode InChI=1S/C35H40O23/c36-8-20-25(45)26(46)27(47)32(55-20)57-29-21(9-51-23(44)7-22(42)43)56-33(30(28(29)48)58-34-31(49)35(50,10-37)11-52-34)53-13-4-16(40)24-17(41)6-18(54-19(24)5-13)12-1-2-14(38)15(39)3-12/h1-6,20-21,25-34,36-40,45-50H,7-11H2,(H,42,43)/t20-,21-,25+,26+,27+,28+,29+,30-,31-,32+,33-,34+,35-/m1/s1
SMILES c1(c2c(cc(c1)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)COC(=O)CC(=O)O)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@](O)(CO1)CO)O)oc(cc2=O)c1ccc(c(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeCapsicum annuum Ref.
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