input word = C00026157

Metabolite InformationStructural formula
Name 2'-Acetylheliotrine
Formula C18H29NO6
Mw 355.19948767
CAS RN 208662-67-3
C_ID C00026157 ,
InChIKey UEMPPXSRXKNHHB-LDFRNWINNA-N
InChICode InChI=1S/C18H29NO6/c1-11(2)18(12(3)23-5,25-13(4)20)17(22)24-10-14-6-8-19-9-7-15(21)16(14)19/h6,11-12,15-16,21H,7-10H2,1-5H3/t12-,15+,16-,18+/m1/s1
SMILES C1C[C@@H]([C@@H]2N1CC=C2COC(=O)[C@@]([C@H](OC)C)(C(C)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiXylariaceaeHypoxylon disciforme Ref.
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