Name |
Ligularizine 12-Epipetasitenine acetate O-Acetyl-12-epifukinotoxin |
Formula |
C21H29NO8 |
Mw |
423.18931691 |
CAS RN |
90364-92-4 |
C_ID |
C00026213
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InChIKey |
RNNVXCSFOWGBQP-KTAHTJDJNA-N |
InChICode |
InChI=1S/C21H29NO8/c1-12-10-21(13(2)29-21)19(26)28-16-7-9-22(5)8-6-15(17(16)24)11-27-18(25)20(12,4)30-14(3)23/h6,12-13,16H,7-11H2,1-5H3/b15-6-/t12-,13-,16-,20+,21-/m1/s1 |
SMILES |
N1(CC=C2C(=O)[C@@H](CC1)OC(=O)[C@]1(C[C@H]([C@@](C(=O)OC2)(OC(=O)C)C)C)O[C@@H]1C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
L-Arg L-Ala L-Asp |
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Ligularia dentata Hara | Ref. |
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