input word = C00063047

Metabolite InformationStructural formula
Name N-[(2E)-4-(beta-D-Glucopyranosyloxy)-3-methyl-2-buten-1-yl]-5'-adenylic acid
Formula C21H32N5O13P
Mw 593.17342264
CAS RN 80550-36-3
C_ID C00063047
InChIKey PDZAZNNMMXJHJE-UHFFFAOYSA-N
InChICode InChI=1S/C21H32N5O13P/c1-9(5-36-21-17(32)15(30)13(28)10(4-27)39-21)2-3-22-18-12-19(24-7-23-18)26(8-25-12)20-16(31)14(29)11(38-20)6-37-40(33,34)35/h2,7-8,10-11,13-17,20-21,27-32H,3-6H2,1H3,(H,22,23,24)(H2,33,34,35)
SMILES CC(=CCNc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O)COC1OC(CO)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePhaseolus vulgaris Ref.
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