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(4'R,5'R)-2-(4',5'-dimethyl-1',3'-dioxolan-2'-yl)-4-hydroxy-1-methoxy-3-(prop-2''-enyl)anthraquinone
SpectraBase Compound ID 16vGnbME4y9
InChI InChI=1S/C23H22O6/c1-5-8-15-16(23-28-11(2)12(3)29-23)22(27-4)18-17(21(15)26)19(24)13-9-6-7-10-14(13)20(18)25/h5-7,9-12,23,26H,1,8H2,2-4H3/t11-,12-/m1/s1
InChIKey BZDDDNXFGPVPEU-VXGBXAGGSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJ4B4Oo0Rer
Name (4'R,5'R)-2-(4',5'-dimethyl-1',3'-dioxolan-2'-yl)-4-hydroxy-1-methoxy-3-(prop-2''-enyl)anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-5-8-15-16(23-28-11(2)12(3)29-23)22(27-4)18-17(21(15)26)19(24)13-9-6-7-10-14(13)20(18)25/h5-7,9-12,23,26H,1,8H2,2-4H3/t11-,12-/m1/s1
InChIKey BZDDDNXFGPVPEU-VXGBXAGGSA-N
Molecular Weight 394.423 g/mol
SMILES Oc1c2c(C(c3c(cccc3)C2=O)=O)c(c(C2O[C@](C)([C@](O2)(C)[H])[H])c1CC=C)OC
SPLASH splash10-014i-0009000000-8aa14917b84ef42a07a8
Source of Spectrum B-47-1295-0
Synonyms (4'R,5'R)-2-(4',5'-dimethyl-1',3'-dioxolan-2'-yl)-4-hydroxy-1-methoxy-3-(prop-2''-enyl)anthraquinone 2-Allyl-3-[(4R,5R)-4,5-dimethyl-1,3-dioxolan-2-yl]-1-hydroxy-4-methoxyanthra-9,10-quinone
Wiley ID 1366699