input word = C00045895

Metabolite InformationStructural formula
Name Epiplakinic acid H
(+)-Epiplakinic acid H
Formula C27H44O4
Mw 432.32395989
CAS RN 467419-76-7
C_ID C00045895 ,
InChIKey BXUWJKHPMWARGU-MGNBBJBHNA-N
InChICode InChI=1S/C27H44O4/c1-22(14-10-7-5-6-8-11-15-24-16-12-9-13-17-24)18-23(2)19-26(3)21-27(4,31-30-26)20-25(28)29/h9,12-13,16-17,22-23H,5-8,10-11,14-15,18-21H2,1-4H3,(H,28,29)/t22-,23+,26+,27-/m0/s1
SMILES CC(CCCCCCCCc1ccccc1)CC(C)C[C@]1(C)C[C@](C)(CC(=O)O)OO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaPlakinidaePlakortis nigra Ref.
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OrganismPlakortis nigra
ReferenceSandler,J.Nat.Prod.,65,(2002),1258