input word = C00016783

Metabolite InformationStructural formula
Name Anthrotainin
Formula C20H17NO9
Mw 415.09033115
CAS RN 148084-40-6
C_ID C00016783 ,
InChIKey HWLAJZAXDIBLQS-MYKRFBFLNA-N
InChICode InChI=1S/C20H17NO9/c1-30-9-3-7-2-8-5-19(28)6-11(23)14(18(21)27)17(26)20(19,29)16(25)13(8)15(24)12(7)10(22)4-9/h2-4,22,24,26,28-29H,5-6H2,1H3,(H2,21,27)/t19-,20+/m1/s1
SMILES COc1cc(O)c2c(O)c3c(cc2c1)C[C@@]1(O)CC(=O)C(C(N)=O)=C(O)[C@@]1(O)C3=O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
FungiHypocreaceaeGliocladium catenulatum Ref.
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