9-Hydroxymegastigma-4,6-dien-3-one (isomer # 1), 6-O-(α-arabinofuranosyl)-β-D-glucopyranoside, TFA

Formula: C₃₆H₃₂F₁₈O₁₇
Molecular weight: 1078.6003
IUPAC Standard InChI: InChI=1S/C36H32F18O17/c1-11-7-13(55)8-30(3,4)14(11)6-5-12(2)64-23-21(71-29(61)36(52,53)54)19(69-27(59)34(46,47)48)17(67-25(57)32(40,41)42)15(66-23)9-62-22-20(70-28(60)35(49,50)51)18(68-26(58)33(43,44)45)16(65-22)10-63-24(56)31(37,38)39/h6-7,12,15-23H,5,8-10H2,1-4H3/t12?,15-,16-,17-,18-,19+,20+,21-,22+,23-/m0/s1
IUPAC Standard InChIKey: GWVVFIFXYLPPRJ-KARAQSPQSA-N
Chemical structure:
This structure is also available as a 2d Mol file
Species with the same structure:
- 9-Hydroxymegastigma-4,6-dien-3-one (isomer # 2), 6-O-(α-arabinofuranosyl)-β-D-glucopyranoside, TFA
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Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Active phase	I	Reference	Comment
Capillary	DB-5	2636.	Sakho, Chassagne, et al., 1997	H2, 60. C @ 3. min, 2. K/min; Column length: 30. m; Column diameter: 0.25 mm; T_end: 220. C

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Sakho, Chassagne, et al., 1997
Sakho, M.; Chassagne, D.; Crouzet, J., African mango glycosidically bound volatile compounds, J. Agric. Food Chem., 1997, 45, 3, 883-888, https://doi.org/10.1021/jf960277b . [all data]

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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