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(1R*,6R*,6aS*,12aS*,12bR*)-1,11-diacetoxy-8-hydroxy-6-methoxy-1,2,3,4,6,6a,12a,12b-octahydrobenz[a]anthracene-7,12-dione
SpectraBase Compound ID 20Wtmu1IOGP
InChI InChI=1S/C23H24O8/c1-10(24)30-14-6-4-5-12-9-16(29-3)20-21(17(12)14)23(28)19-15(31-11(2)25)8-7-13(26)18(19)22(20)27/h7-9,14,16-17,20-21,26H,4-6H2,1-3H3/t14-,16-,17-,20-,21+/m1/s1
InChIKey DHYOUIFDYPUHIC-KSDRABAPSA-N
Mol Weight 428.44 g/mol
Molecular Formula C23H24O8
Exact Mass 428.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FC6udQuVbEC
Name (1R*,6R*,6aS*,12aS*,12bR*)-1,11-diacetoxy-8-hydroxy-6-methoxy-1,2,3,4,6,6a,12a,12b-octahydrobenz[a]anthracene-7,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24O8
InChI InChI=1S/C23H24O8/c1-10(24)30-14-6-4-5-12-9-16(29-3)20-21(17(12)14)23(28)19-15(31-11(2)25)8-7-13(26)18(19)22(20)27/h7-9,14,16-17,20-21,26H,4-6H2,1-3H3/t14-,16-,17-,20-,21+/m1/s1
InChIKey DHYOUIFDYPUHIC-KSDRABAPSA-N
Molecular Weight 428.437 g/mol
SMILES Oc1c2c(C([C@@]3([C@]([C@](OC)(C=C4[C@@]3([C@](OC(=O)C)(CCC4)[H])[H])[H])([H])C2=O)[H])=O)c(OC(=O)C)cc1
SPLASH splash10-00p0-0009000000-8d8db1206e29b03f64b9
Source of Spectrum JA-50-301-0
Synonyms (1R,6R,6aS,12aS,12bR)-1-(acetyloxy)-8-hydroxy-6-methoxy-7,12-dioxo-1,2,3,4,6,6a,7,12,12a,12b-decahydrobenzo[a]anthracen-11-yl acetate
Wiley ID 1380680