input word = C00000622

Metabolite InformationStructural formula
Name (+)-Megacerotonic acid
Formula C18H14O7
Mw 342.0739528
CAS RN 130396-76-8
C_ID C00000622 ,
InChIKey ARPWMKRUUOTSGU-AIAQTCMDNA-N
InChICode InChI=1S/C18H14O7/c19-11-4-1-9(2-5-11)7-12-15(16(17(22)23)25-18(12)24)10-3-6-13(20)14(21)8-10/h1-8,15-16,19-21H,(H,22,23)/b12-7+/t15-,16-/m1/s1
SMILES O=C1O[C@@H](C(=O)O)[C@H](c2ccc(O)c(O)c2)/C1=Cc1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDendrocerotaceaeMegaceros flagellaris Ref.
PlantaeNotothyladaceaeNotothylas temperata Ref.
PlantaeNotothyladaceaePhaeoceros laevis Ref.
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OrganismMegaceros flagellaris
ReferenceTakeda,Tetrahedron Lett,31,(1990),4159

Takeda,Bryophytes:Their Chemistry and Chemical Taxonomy.Clarendon Press.Oxford,(1990),p 201

Brown,Tetrahedron,51,(1995),13 061