input word = C00038930

Metabolite InformationStructural formula
Name Daphneticin 4''-beta-D-glucopyranoside
Formula C26H28O13
Mw 548.15299098
CAS RN 404861-40-1
C_ID C00038930 ,
InChIKey UFNILYRCPSTPHP-VJNGJFHRNA-N
InChICode InChI=1S/C26H28O13/c1-33-14-7-12(8-15(34-2)24(14)39-26-21(32)20(31)19(30)16(9-27)37-26)22-17(10-28)36-25-13(35-22)5-3-11-4-6-18(29)38-23(11)25/h3-8,16-17,19-22,26-28,30-32H,9-10H2,1-2H3/t16-,17-,19-,20+,21-,22-,26+/m1/s1
SMILES O1c2c(O[C@@H]([C@H]1CO)c1cc(c(c(c1)OC)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)OC)ccc1c2oc(=O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeDaphne feddei Ref.
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