input word = C00063149

Metabolite InformationStructural formula
Name 17-Decarboxyneobetanin
Formula C23H24N2O11
Mw 504.13800963
CAS RN 852290-49-4
C_ID C00063149
InChIKey WJEMSCKDKUZHHE-VRKSCTTKSA-N
InChICode InChI=1S/C23H24N2O11/c26-9-17-18(28)19(29)20(30)23(36-17)35-16-7-11-6-14(22(33)34)25(13(11)8-15(16)27)4-2-10-1-3-24-12(5-10)21(31)32/h1-5,7-8,14,17-20,23,26-30H,6,9H2,(H,31,32)(H,33,34)/t14-,17+,18+,19-,20+,23+/m0/s1
SMILES O=C(O)c1cc(C=CN2c3cc(O)c(OC4OC(CO)C(O)C(O)C4O)cc3CC2C(=O)O)ccn1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllalesBeta vulgaris Ref.
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