input word = C00010090

Metabolite InformationStructural formula
Name Retusin 7-O-neohesperidoside
Formula C28H32O14
Mw 592.17920573
CAS RN 78386-04-6
C_ID C00010090 ,
InChIKey BLCSJLFCYHDNBE-FWBYGNMHNA-N
InChICode InChI=1S/C28H32O14/c1-11-18(30)22(34)24(36)27(39-11)42-26-23(35)20(32)17(9-29)41-28(26)40-16-8-7-14-19(31)15(10-38-25(14)21(16)33)12-3-5-13(37-2)6-4-12/h3-8,10-11,17-18,20,22-24,26-30,32-36H,9H2,1-2H3/t11-,17+,18-,20-,22-,23-,24+,26+,27-,28+/m0/s1
SMILES O(c1c(c2c(c(=O)c(co2)c2ccc(cc2)OC)cc1)O)[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeProsopis juliflora Ref.
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