input word = C00056968

Metabolite InformationStructural formula
Name Panajaponin
Formula C27H49NO9
Mw 531.34073217
CAS RN 1240641-07-9
C_ID C00056968
InChIKey BIKDUZIBFQKKLW-DMMAEYNNSA-N
InChICode InChI=1S/C28H51NO9/c1-4-6-8-10-12-14-16-21(31)20(19-37-26-25(34)24(33)23(32)22(18-30)38-26)29-27(35)28(3,36)17-15-13-11-9-7-5-2/h12-15,20-26,30-34,36H,4-11,16-19H2,1-3H3,(H,29,35)/b14-12+,15-13+/t20-,21-,22+,23+,24-,25+,26+,28+/m0/s1
SMILES CCCCC/C=C/C[C@@](C)(O)C(N[C@@H](CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)[C@@H](O)C/C=C/CCCCC)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax japonicus Ref.
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