input word = C00046803

Metabolite InformationStructural formula
Name Lyngbyatoxin A acetate
Formula C29H41N3O3
Mw 479.3147922
CAS RN 70497-15-3
C_ID C00046803 ,
InChIKey WUGMGNWGTQDXDH-VWXDLVHONA-N
InChICode InChI=1S/C29H41N3O3/c1-9-29(7,14-10-11-18(2)3)23-12-13-24-25-21(16-30-26(23)25)15-22(17-35-20(6)33)31-28(34)27(19(4)5)32(24)8/h9,11-13,16,19,22,27,30H,1,10,14-15,17H2,2-8H3,(H,31,34)/t22-,27-,29-/m0/s1
SMILES C=C[C@@](C)(CCC=C(C)C)c1ccc2c3c(c[nH]c13)C[C@@H](COC(C)=O)NC(=O)[C@H](C(C)C)N2C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeStylocheilus longicauda Ref.
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