input word = C00049810

Metabolite InformationStructural formula
Name Maculalactone E
(+)-Maculalactone E
Formula C34H30O4
Mw 502.21440945
CAS RN 199600-37-8
C_ID C00049810 ,
InChIKey NQTOOGBFGKMSCH-LCHQYCTINA-N
InChICode InChI=1S/C34H30O4/c35-30-22-29(26-17-9-3-10-18-26)33(23-25-15-7-2-8-16-25)31(34(30,37)27-19-11-4-12-20-27)28(32(36)38-33)21-24-13-5-1-6-14-24/h1-20,29-30,35,37H,21-23H2/t29-,30+,33-,34-/m1/s1
SMILES C1[C@@H]([C@@](C2=C(C(=O)O[C@@]2([C@H]1c1ccccc1)Cc1ccccc1)Cc1ccccc1)(c1ccccc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Kyrtuthrix maculans Ref.
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OrganismKyrtuthrix maculans
ReferenceLee,J.Nat.Prod.,61,(1998),29