Ardisiaquinone C(7)

SpectraBase Compound ID	DA5PKeobLJR
InChI	InChI=1S/C32H42O9/c1-22(33)41-32-24(31(38)28(40-3)21-26(32)35)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-23-29(36)25(34)20-27(39-2)30(23)37/h4-5,20-21,36H,6-19H2,1-3H3/b5-4+
InChIKey	YPCRDURZWBEPSV-SNAWJCMRSA-N Google Search
Mol Weight	570.7 g/mol
Molecular Formula	C32H42O9
Exact Mass	570.282883 g/mol

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SpectraBase Spectrum ID	JWJLcKljf0b
Name	Ardisiaquinone C(7)
Alternate Name(s)	2-[(8E)-16-(2-hydroxy-5-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl)-8-hexadecenyl]-4-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl acetate
CAS Registry Number	26894-48-4
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C32H42O9
InChI	InChI=1S/C32H42O9/c1-22(33)41-32-24(31(38)28(40-3)21-26(32)35)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-23-29(36)25(34)20-27(39-2)30(23)37/h4-5,20-21,36H,6-19H2,1-3H3/b5-4+
InChIKey	YPCRDURZWBEPSV-SNAWJCMRSA-N
Molecular Weight	570.679 g/mol
SMILES	OC1=C(CCCCCCC\C=C\CCCCCCCC2=C(C(=O)C=C(C2=O)OC)OC(=O)C)C(C(=CC1=O)OC)=O
SPLASH	splash10-014i-0900040000-ddbdbfc1a27f639fb804
Source of Spectrum	W5-1989-58002-7534
Wiley ID	1407711