input word = C00057314

Metabolite InformationStructural formula
Name Neocycasin B
Formula C14H26N2O12
Mw 414.14857431
CAS RN 2697-20-3
C_ID C00057314
InChIKey TUCYOFDDNLIGIA-NXVVXOECSA-N
InChICode InChI=1S/C14H26N2O12/c1-16(24)15-4-26-14-12(23)10(21)8(19)6(28-14)3-25-13-11(22)9(20)7(18)5(2-17)27-13/h5-14,17-23H,2-4H2,1H3/b16-15-
SMILES OCC(O1)C(O)C(O)C(O)C1OCC2OC(OCN=N(C)=O)C(O)C(O)C2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCycadaceaeCycas revoluta Ref.
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