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ARTOCHAMIN_B;2,3,8,10-TETRAHYDROXY-11-(3-METHYL-2-BUTENYL)-6-(2-METHYL-1-PROPENYL)-6H,7H-[1]-BENZOPYRAN-[4,3-B]-[1]-BENZOPYRAN-7-ONE
SpectraBase Compound ID F1AD4pZv4aC
InChI InChI=1S/C25H24O7/c1-11(2)5-6-13-15(26)9-18(29)21-23(30)22-20(7-12(3)4)31-19-10-17(28)16(27)8-14(19)25(22)32-24(13)21/h5,7-10,20,26-29H,6H2,1-4H3
InChIKey HEXPWLIZWQZUCB-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 8avfoErpHEp
Name 2,3,8,10-tetrahydroxy-11-(3-methyl-2-butenyl)-6-(2-methyl-1-propenyl)-6H,7H-[1]benzopyrano[4,3-b][1]benzopyran-7-one
Alternate Name(s) Artochamin B
Appearance Yellow amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O7
InChI InChI=1S/C25H24O7/c1-11(2)5-6-13-15(26)9-18(29)21-23(30)22-20(7-12(3)4)31-19-10-17(28)16(27)8-14(19)25(22)32-24(13)21/h5,7-10,20,26-29H,6H2,1-4H3
InChIKey HEXPWLIZWQZUCB-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 = +29 (c = 0.25, MeOH)
Reported Formula C25H24O7
SMILES Oc1cc(c(c2c1C(C1=C(c3c(cc(c(c3)O)O)OC1C=C(C)C)O2)=O)CC=C(C)C)O
SPLASH splash10-0089-0109800000-d302b3084e36ec1fb71b
Source of Spectrum G4-67-760-2
Wiley ID 1884011