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COMNOSTIN-E;5-[(5-CARBOXY-2-HYDROXY)-BENZYL]-11-ACETYL-2,5,6,8A-TETRA-METHYL-DODECA-HYDRO-CYCLO-PENTA-(A)-NAPHTHALENE
SpectraBase Compound ID 7INdZphN9cp
InChI InChI=1S/C27H38O4/c1-16-10-12-26(4)22-9-7-20(17(2)28)25(22,3)13-11-23(26)27(16,5)15-19-14-18(24(30)31)6-8-21(19)29/h6,8,14,16,20,22-23,29H,7,9-13,15H2,1-5H3,(H,30,31)/t16-,20+,22?,23?,25+,26-,27-/m1/s1
InChIKey PCLWWUDFTVTRTJ-ATCNUFKCSA-N
Mol Weight 426.6 g/mol
Molecular Formula C27H38O4
Exact Mass 426.27701 g/mol
Enantiomer InChIKey PCLWWUDFTVTRTJ-XDALOQAZSA-N
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