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2H-1-Benzopyran-3-ol, 4-(2,4-dimethoxyphenyl)-3,4-dihydro-7,8-dimethoxy-2-(4-methoxyphenyl) -, acetate, [2R-(2.alpha.,3.alpha.,4.beta.)]-
SpectraBase Compound ID KWdIEwO3SMP
InChI InChI=1S/C28H30O8/c1-16(29)35-28-24(20-12-11-19(31-3)15-23(20)33-5)21-13-14-22(32-4)27(34-6)26(21)36-25(28)17-7-9-18(30-2)10-8-17/h7-15,24-25,28H,1-6H3/t24-,25+,28+/m0/s1
InChIKey BKRHDCYTUYGBQH-BXTSTYNKSA-N
Mol Weight 494.54 g/mol
Molecular Formula C28H30O8
Exact Mass 494.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2ecFQMmh5g
Name 2H-1-Benzopyran-3-ol, 4-(2,4-dimethoxyphenyl)-3,4-dihydro-7,8-dimethoxy-2-(4-methoxyphenyl) -, acetate, [2R-(2.alpha.,3.alpha.,4.beta.)]-
CAS Registry Number 69120-24-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30O8
InChI InChI=1S/C28H30O8/c1-16(29)35-28-24(20-12-11-19(31-3)15-23(20)33-5)21-13-14-22(32-4)27(34-6)26(21)36-25(28)17-7-9-18(30-2)10-8-17/h7-15,24-25,28H,1-6H3/t24-,25+,28+/m0/s1
InChIKey BKRHDCYTUYGBQH-BXTSTYNKSA-N
Molecular Weight 494.540 g/mol
SMILES c12c([C@](c3c(cc(cc3)OC)OC)([C@]([C@](O1)(c1ccc(cc1)OC)[H])(OC(=O)C)[H])[H])ccc(c2OC)OC
SPLASH splash10-00e9-0240900000-1142f63870f14d561251
Source of Spectrum KC-1981-1217-0
Synonyms (2R,3R,4S)-2,3-cis-3,4-trans-3-acetoxy-4',7,8-trimethoxy-4-(2,4-dimethoxyphenyl)flavan (2R,3R,4S)-4-(2,4-dimethoxyphenyl)-7,8-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl acetate
Wiley ID 1397930