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ARTOCHAMIN_E;5,6-DIHYDRO-1,3,4,8,10-PENTAHYDROXY-5-(1-METHYLETHENYL)-11-(3-METHYL-2-BUTENYL)-7H-BENZO-[C]-XANTHEN-7-ONE
SpectraBase Compound ID 6dLNqYYHby3
InChI InChI=1S/C25H24O7/c1-10(2)5-6-12-15(26)8-17(28)21-22(30)14-7-13(11(3)4)19-20(25(14)32-24(12)21)16(27)9-18(29)23(19)31/h5,8-9,13,26-29,31H,3,6-7H2,1-2,4H3
InChIKey YLQHACOUEASQOY-UHFFFAOYSA-N
Mol Weight 436.46 g/mol
Molecular Formula C25H24O7
Exact Mass 436.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KvUYbWI5HJQ
Name 5,6-dihydro-1,3,4,8,10-pentahydroxy-5-(1-methylethenyl)-11-(3-methyl-2-butenyl)-7H-benzo[c]xanthen-7-one
Alternate Name(s) Artochamin E
Appearance Yellow amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O7
InChI InChI=1S/C25H24O7/c1-10(2)5-6-12-15(26)8-17(28)21-22(30)14-7-13(11(3)4)19-20(25(14)32-24(12)21)16(27)9-18(29)23(19)31/h5,8-9,13,26-29,31H,3,6-7H2,1-2,4H3
InChIKey YLQHACOUEASQOY-UHFFFAOYSA-N
Instrument Name Agilent 5973N or HP 5989A
Ionization Type EI
Literature Reference DOI 10.1021/np030467y
Molecular Weight 436.460 g/mol
Optical Rotation [a]D20 = 0 (c = 0.25, MeOH)
Reported Formula C25H24O7
SMILES Oc1cc(c(c2c1C(C1=C(c3c(c(c(cc3O)O)O)C(C1)C(=C)C)O2)=O)CC=C(C)C)O
SPLASH splash10-001r-0009100000-bf805bfa95245036b71a
Source of Spectrum G4-67-760-5
Wiley ID 1884014