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RHUSCHALCONE-VI;4,2',4',4'',2''',4'''-HEXAHYDROXY-3,5'''-BICHALCONE
SpectraBase Compound ID ChaGFpCtiiN
InChI InChI=1S/C30H22O8/c31-19-6-1-17(2-7-19)3-10-27(35)24-15-23(29(37)16-30(24)38)22-13-18(5-12-26(22)34)4-11-25(33)21-9-8-20(32)14-28(21)36/h1-16,31-32,34,36-38H/b10-3+,11-4+
InChIKey GKIHPJBWPIVSEV-HULALXFYSA-N
Mol Weight 510.5 g/mol
Molecular Formula C30H22O8
Exact Mass 510.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5o0KQoIGCdQ
Name 4,2',4',4'',2''',4'''-Hexahydroxy-3,5'''-bichalcone
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H22O8
InChI InChI=1S/C30H22O8/c31-19-6-1-17(2-7-19)3-10-27(35)24-15-23(29(37)16-30(24)38)22-13-18(5-12-26(22)34)4-11-25(33)21-9-8-20(32)14-28(21)36/h1-16,31-32,34,36-38H/b10-3+,11-4+
InChIKey GKIHPJBWPIVSEV-HULALXFYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np020138q
Molecular Weight 510.498 g/mol
Optical Rotation [a]D25 = -6.3 (c = 0.03, MeOH
SMILES Oc1cc(c(cc1-c1cc(\C=C\C(c2ccc(cc2O)O)=O)ccc1O)C(=O)\C=C\c1ccc(cc1)O)O
SPLASH splash10-02ta-0698320000-17d30cef378e06f38c8e
Source of Spectrum G4-66-603-6
Synonyms Rhuschalcone VI
Wiley ID 1881381