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(1R*,3R*,6R*,12bS*)-1,11-diacetoxy-8-hydroxy-6-methoxy-3-methyl-1,2,3,4,6,12b-hexahydrobenz[a]anthracene-7-12-dione
SpectraBase Compound ID 5UICFS3B1RY
InChI InChI=1S/C24H24O8/c1-10-7-13-9-16(30-4)21-22(18(13)17(8-10)32-12(3)26)24(29)20-15(31-11(2)25)6-5-14(27)19(20)23(21)28/h5-6,9-10,16-18,27H,7-8H2,1-4H3/t10-,16-,17-,18-/m1/s1
InChIKey COPGIWWHUJPHTG-SUOLYPAASA-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 FX7ISjp0IfL
Name (1R*,3R*,6R*,12bS*)-1,11-diacetoxy-8-hydroxy-6-methoxy-3-methyl-1,2,3,4,6,12b-hexahydrobenz[a]anthracene-7-12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24O8
InChI InChI=1S/C24H24O8/c1-10-7-13-9-16(30-4)21-22(18(13)17(8-10)32-12(3)26)24(29)20-15(31-11(2)25)6-5-14(27)19(20)23(21)28/h5-6,9-10,16-18,27H,7-8H2,1-4H3/t10-,16-,17-,18-/m1/s1
InChIKey COPGIWWHUJPHTG-SUOLYPAASA-N
Molecular Weight 440.448 g/mol
SMILES Oc1c2c(c(OC(=O)C)cc1)C(C1=C(C2=O)[C@@](C=C2C[C@@](C)(C[C@]([C@]12[H])(OC(=O)C)[H])[H])(OC)[H])=O
SPLASH splash10-001i-0009000000-7c50a5a261a8a68bf6d8
Source of Spectrum JA-50-301-0
Synonyms (1R,3R,6R,12bS)-1-(acetyloxy)-8-hydroxy-6-methoxy-3-methyl-7,12-dioxo-1,2,3,4,6,7,12,12b-octahydrobenzo[a]anthracen-11-yl acetate Acetic acid (1R,3R,6R,12bS)-1-acetoxy-8-hydroxy-6-methoxy-3-methyl-7,12-dioxo-1,2,3,4,6,7,12,12b-octahydro-benzo[a]anthracen-11-yl ester
Wiley ID 1384666