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COCHINCHINONE-B;1,3,6,7-TETRAHYDROXY-2-(3-METHYL-2-BUTENYL)-5-(3,7-DIMETHYL-2,6-OCTADIENYL)-XANTHONE
SpectraBase Compound ID Be7fGu9gPGx
InChI InChI=1S/C28H32O6/c1-15(2)7-6-8-17(5)10-12-19-25(31)22(30)13-20-27(33)24-23(34-28(19)20)14-21(29)18(26(24)32)11-9-16(3)4/h7,9-10,13-14,29-32H,6,8,11-12H2,1-5H3/b17-10+
InChIKey QRQRZDHZRAXLKZ-LICLKQGHSA-N
Mol Weight 464.6 g/mol
Molecular Formula C28H32O6
Exact Mass 464.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Chb2Hvg6S
Name (E)-5-(3,7-dimethylocta-2,6-dien-1-yl)-1,3,6,7-tetrahydroxy-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
Alternate Name(s) Cochinchinone B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O6
InChI InChI=1S/C28H32O6/c1-15(2)7-6-8-17(5)10-12-19-25(31)22(30)13-20-27(33)24-23(34-28(19)20)14-21(29)18(26(24)32)11-9-16(3)4/h7,9-10,13-14,29-32H,6,8,11-12H2,1-5H3/b17-10+
InChIKey QRQRZDHZRAXLKZ-LICLKQGHSA-N
Molecular Weight 464.558 g/mol
SMILES Oc1c2c(Oc3c(cc(c(c3C\C=C\(CCC=C(C)C)C)O)O)C2=O)cc(c1CC=C(C)C)O
SPLASH splash10-0a6r-9432500000-ad0cf5b307a5d79a224b
Source of Spectrum W. Mahabusarakam, et al. Phytochemistry, V. 67, 2006, P.470-474
Wiley ID 1817576