input word = C00042273

Metabolite InformationStructural formula
Name Bazzania acid
(-)-Bazzania acid
Formula C18H16O11
Mw 408.06926136
CAS RN 217176-44-8
C_ID C00042273 ,
InChIKey VJOTYOQIXUAZMO-DRGUVRGYNA-N
InChICode InChI=1S/C18H16O11/c19-10-2-1-7(3-11(10)20)15-14(17(27)28)9(16(25)26)4-8(5-12(21)22)18(15,29)6-13(23)24/h1-5,14-15,19-20,29H,6H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)/b8-5-/t14-,15+,18+/m1/s1
SMILES c1(ccc(cc1O)[C@H]1[C@@H](C(=C/C(=C/C(=O)O)/[C@]1(CC(=O)O)O)C(=O)O)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLepidoziaceaeBazzania trilobata Ref.
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