input word = C00014062

Metabolite InformationStructural formula
Name Isoorientin 2''-O-arabinoside
Formula C26H28O15
Mw 580.14282023
CAS RN 182951-72-0
C_ID C00014062 ,
InChIKey FGYOJUYXCCFUMF-XEOHYIRONA-N
InChICode InChI=1S/C26H28O15/c27-6-16-20(34)22(36)25(41-26-23(37)19(33)13(32)7-38-26)24(40-16)18-12(31)5-15-17(21(18)35)11(30)4-14(39-15)8-1-2-9(28)10(29)3-8/h1-5,13,16,19-20,22-29,31-37H,6-7H2/t13-,16+,19+,20+,22-,23-,24-,25+,26+/m0/s1
SMILES O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[C@@H]3OC[C@H](O)[C@H](O)C3O)c(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea triumfetti Ref.
PlantaePoaceaeAvena sativa Ref.
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