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Cyclomorusin
SpectraBase Compound ID KBP3R0lgulj
InChI InChI=1S/C25H22O6/c1-12(2)9-19-21-22(28)20-16(27)11-18-15(7-8-25(3,4)31-18)23(20)30-24(21)14-6-5-13(26)10-17(14)29-19/h5-11,19,26-27H,1-4H3
InChIKey GDQXJMLXEYSICD-UHFFFAOYSA-N
Mol Weight 418.45 g/mol
Molecular Formula C25H22O6
Exact Mass 418.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rBM8fd5bEq
Name Cyclomorusin
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22O6
InChI InChI=1S/C25H22O6/c1-12(2)9-19-21-22(28)20-16(27)11-18-15(7-8-25(3,4)31-18)23(20)30-24(21)14-6-5-13(26)10-17(14)29-19/h5-11,19,26-27H,1-4H3
InChIKey GDQXJMLXEYSICD-UHFFFAOYSA-N
Molecular Weight 418.445 g/mol
SMILES Oc1c2c(OC3=C(C(Oc4cc(ccc34)O)C=C(C)C)C2=O)c2C=CC(Oc2c1)(C)C
SPLASH splash10-0udi-0000900000-8ce2121d0ae3206f4b18
Source of Spectrum X2-56-1596-2
Wiley ID 1605077