input word = C00003324

Metabolite InformationStructural formula
Name Mellitoxin
Formula C15H18O7
Mw 310.10525293
CAS RN 3484-46-6
C_ID C00003324 ,
InChIKey DWCJGLPGZULWPZ-XANKYBGENA-N
InChICode InChI=1S/C15H18O7/c1-5(2)14(18)6-11(17)22-8(14)7(16)12(3)13(4-20-13)9-10(21-9)15(6,12)19/h6-10,16,18-19H,1,4H2,2-3H3/t6-,7-,8?,9-,10+,12+,13-,14-,15+/m1/s1
SMILES C=C(C)[C@]1(O)[C@H]2OC(=O)[C@@H]1[C@]1(O)[C@H]3O[C@H]3[C@]3(CO3)[C@]1(C)[C@@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeToxicodendron globosum Ref.
PlantaeCoriariaceaeCoriaria arborea Ref.
--Scolypopa australis Ref.
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