input word = C00005546

Metabolite InformationStructural formula
Name Isorhamnetin 3-gentiobioside
Formula C28H32O17
Mw 640.1639496
CAS RN 17429-69-5
C_ID C00005546 ,
InChIKey GPZLFWVUSQREQH-PIHYUUDINA-N
InChICode InChI=1S/C28H32O17/c1-40-13-4-9(2-3-11(13)31)25-26(20(35)17-12(32)5-10(30)6-14(17)42-25)45-28-24(39)22(37)19(34)16(44-28)8-41-27-23(38)21(36)18(33)15(7-29)43-27/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAstragalus aegobromus Ref.
PlantaeFabaceaeAstragalus alopecurus Ref.
PlantaeFabaceaeAstragalus brachycarpus Ref.
PlantaeFabaceaeAstragalus buchtormensis Ref.
PlantaeFabaceaeAstragalus dasyanthus Ref.
PlantaeFabaceaeAstragalus exscapus Ref.
PlantaeFabaceaeAstragalus melilotoides Ref.
PlantaeFabaceaeAstragalus onobrychis Ref.
PlantaeFabaceaeCytisus sp. Ref.
PlantaeFabaceaeOnonis fruticosa Ref.
PlantaeMoraceaeArtocarpus spp. Ref.
PlantaeZygophyllaceaeTribulus pentandrus Ref.
PlantaeZygophyllaceaeTribulus terrestris Ref.
zoom in