input word = C00001600

Metabolite InformationStructural formula
Name Musca-aurin-II
Formula C18H16N2O10
Mw 420.08049475
CAS RN 12624-17-8
C_ID C00001600 ,
InChIKey XWXLDVGDOHFZSG-WOAYRHMDNA-N
InChICode InChI=1S/C18H16N2O10/c21-14-7-9(6-13(30-14)18(28)29)5-10(15(22)23)19-2-1-8-3-11(16(24)25)20-12(4-8)17(26)27/h1-3,6-7,10,12,20H,4-5H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29)/b8-1-,19-2+/t10-,12-/m0/s1
SMILES C(=N\[C@@H](Cc1cc(oc(=O)c1)C(=O)O)C(=O)O)/C=C/1\C[C@H](NC(=C1)C(=O)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
FungiAmanitaceaeAmanita muscaria Ref.
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