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KENGAQUINONE;3,8,9-TRIHYDROXY-6-METHYL-2,5-BIS-(3,3-DIMETHYLALLYL)-1,4-ANTHRAQUINONE
SpectraBase Compound ID BD7HGidYm2o
InChI InChI=1S/C25H26O5/c1-12(2)6-8-15-14(5)10-19(26)20-17(15)11-18-21(25(20)30)22(27)16(9-7-13(3)4)23(28)24(18)29/h6-7,10-11,26,28,30H,8-9H2,1-5H3
InChIKey PVDCTEHETGPYFG-UHFFFAOYSA-N
Mol Weight 406.48 g/mol
Molecular Formula C25H26O5
Exact Mass 406.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94vgGnrgMab
Name 3,8,9-Trihydroxy-6-methyl-2,5-bis[3',3'-dimethylallyl)-1,4-anthraquinone
Alternate Name(s) Kengaquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O5
InChI InChI=1S/C25H26O5/c1-12(2)6-8-15-14(5)10-19(26)20-17(15)11-18-21(25(20)30)22(27)16(9-7-13(3)4)23(28)24(18)29/h6-7,10-11,26,28,30H,8-9H2,1-5H3
InChIKey PVDCTEHETGPYFG-UHFFFAOYSA-N
Molecular Weight 406.478 g/mol
SMILES OC1=C(C(c2c(c3c(cc(c(c3cc2C1=O)CC=C(C)C)C)O)O)=O)CC=C(C)C
SPLASH splash10-0f79-1009000000-79ad92f35eb879e1fba3
Source of Spectrum G4-69-232-1
Wiley ID 1694615