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Methyl (3S)-3-hydroxy-4-(7'-methoxy-2'-methyl-6',11'-dioxo-6',11'-dihydroanthra[1',2'-b]furan-8'-yl)-3-methylbutanoate
SpectraBase Compound ID 238LcBWmT4e
InChI InChI=1S/C24H22O7/c1-12-9-13-5-7-16-19(23(13)31-12)21(27)15-8-6-14(22(30-4)18(15)20(16)26)10-24(2,28)11-17(25)29-3/h5-9,28H,10-11H2,1-4H3/t24-/m0/s1
InChIKey ZKXMEMIJFLUNMY-DEOSSOPVSA-N
Mol Weight 422.43 g/mol
Molecular Formula C24H22O7
Exact Mass 422.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ex8iTVAzw
Name Methyl (3S)-3-hydroxy-4-(7'-methoxy-2'-methyl-6',11'-dioxo-6',11'-dihydroanthra[1',2'-b]furan-8'-yl)-3-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22O7
InChI InChI=1S/C24H22O7/c1-12-9-13-5-7-16-19(23(13)31-12)21(27)15-8-6-14(22(30-4)18(15)20(16)26)10-24(2,28)11-17(25)29-3/h5-9,28H,10-11H2,1-4H3/t24-/m0/s1
InChIKey ZKXMEMIJFLUNMY-DEOSSOPVSA-N
Molecular Weight 422.433 g/mol
SMILES O[C@](CC(=O)OC)(Cc1c(c2C(c3c(C(c2cc1)=O)c1oc(C)cc1cc3)=O)OC)C
SPLASH splash10-052g-0029000000-f57ef47293b3bd2886a9
Source of Spectrum B-47-2149-0
Synonyms Methyl (3S)-3-hydroxy-4-(7-methoxy-2-methyl-6,11-dioxo-6,11-dihydroanthra[1,2-b]furan-8-yl)-3-methylbutanoate Methyl (3S)-3-hydroxy-4-(7-methoxy-2-methyl-6,11-dioxo-6,11-dihydroanthra[2,1-b]furan-8-yl)-3-methylbutanoate
Wiley ID 1378628