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Butyrolactone IV [3-Hydroxy-5-{2-(1-hydroxy-1-methylethyl)-2(R)-2,3-dihydrobenzo[b]furan-5-ylmethyl}-4-(4-hydroxyphenyl)-5-methoxycarbonyl-(5R)-2,5-dihydro-2-furanone]
SpectraBase Compound ID 9EmDAWDjyVH
InChI InChI=1S/C24H24O8/c1-23(2,29)18-11-15-10-13(4-9-17(15)31-18)12-24(22(28)30-3)19(20(26)21(27)32-24)14-5-7-16(25)8-6-14/h4-10,18,25-26,29H,11-12H2,1-3H3/t18-,24-/m1/s1
InChIKey NVAIFFOQCAKMAH-HOYKHHGWSA-N
Mol Weight 440.45 g/mol
Molecular Formula C24H24O8
Exact Mass 440.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ey6C71ZIPg
Name Butyrolactone IV [3-Hydroxy-5-{2-(1-hydroxy-1-methylethyl)-2(R)-2,3-dihydrobenzo[b]furan-5-ylmethyl}-4-(4-hydroxyphenyl)-5-methoxycarbonyl-(5R)-2,5-dihydro-2-furanone]
Alternate Name(s) (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-[[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-5-yl]methyl]-5-oxo-2-furancarboxylic acid methyl ester Methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-[[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]methyl]-5-oxofuran-2-carboxylate Methyl (2R)-4-hydroxy-2-[[(2R)-2-(1-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-5-yl]methyl]-3-(4-hydroxyphenyl)-5-oxo-furan-2-carboxylate Methyl (2R)-3-(4-hydroxyphenyl)-4-oxidanyl-5-oxidanylidene-2-[[(2R)-2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]methyl]furan-2-carboxylate
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Formula C24H24O8
InChI InChI=1S/C24H24O8/c1-23(2,29)18-11-15-10-13(4-9-17(15)31-18)12-24(22(28)30-3)19(20(26)21(27)32-24)14-5-7-16(25)8-6-14/h4-10,18,25-26,29H,11-12H2,1-3H3/t18-,24-/m1/s1
InChIKey NVAIFFOQCAKMAH-HOYKHHGWSA-N
Molecular Weight 440.448 g/mol
SMILES OC=1C(O[C@](C1c1ccc(cc1)O)(C(=O)OC)Cc1cc2C[C@](C(O)(C)C)(Oc2cc1)[H])=O
SPLASH splash10-0a5d-1934000000-844bd00fe4a25de3bc7b
Source of Spectrum E2-48-561-3
Wiley ID 1555149