input word = C00007905

Metabolite InformationStructural formula
Name Okanin 4-methyl ether 3'-(6''-acetylglucoside)
Formula C24H26O12
Mw 506.1424263
CAS RN 135618-13-2
C_ID C00007905 ,
InChIKey XXOXVVPQGPERBF-LPDJEKDHNA-N
InChICode InChI=1S/C24H26O12/c1-11(25)34-10-18-20(30)21(31)22(32)24(35-18)36-23-15(27)7-5-13(19(23)29)14(26)6-3-12-4-8-17(33-2)16(28)9-12/h3-9,18,20-22,24,27-32H,10H2,1-2H3/b6-3+/t18-,20-,21-,22+,24-/m0/s1
SMILES c1(c(c(c(cc1)C(=O)/C=C/c1cc(c(cc1)OC)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)COC(=O)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio pseudotites Ref.
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