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(7'S,8R,8'R)-3',4'-Dimethoxy-8'-(hydroxymethyl)-3,4-(methylenedioxy)-lignano-9,7'-lactone
SpectraBase Compound ID EErAua7j6ry
InChI InChI=1S/C21H22O7/c1-24-16-6-4-13(9-18(16)25-2)20-15(10-22)14(21(23)28-20)7-12-3-5-17-19(8-12)27-11-26-17/h3-6,8-9,14-15,20,22H,7,10-11H2,1-2H3/t14-,15+,20-/m1/s1
InChIKey VEBADBYSDAQDLW-QEEYODRMSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ay4DlN2n05V
Name (7'S,8R,8'R)-3',4'-Dimethoxy-8'-(hydroxymethyl)-3,4-(methylenedioxy)-lignano-9,7'-lactone
Alternate Name(s) (3R,4R,5S)-3-(benzo[d][1,3]dioxol-5-ylmethyl)-5-(3,4-dimethoxyphenyl)-4-(hydroxymethyl)dihydrofuran-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-24-16-6-4-13(9-18(16)25-2)20-15(10-22)14(21(23)28-20)7-12-3-5-17-19(8-12)27-11-26-17/h3-6,8-9,14-15,20,22H,7,10-11H2,1-2H3/t14-,15+,20-/m1/s1
InChIKey VEBADBYSDAQDLW-QEEYODRMSA-N
Molecular Weight 386.400 g/mol
SMILES OC[C@@]1([C@](OC([C@@]1(Cc1cc2OCOc2cc1)[H])=O)(c1cc(OC)c(cc1)OC)[H])[H]
SPLASH splash10-014r-0905000000-fd02c1958964cb3c55e5
Source of Spectrum F5-6-2625-4c
Wiley ID 1733466