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(9R)-4-methoxy-6,9,11-tris(oxidanyl)-9-[(1R)-1-oxidanylethyl]-8,10-dihydro-7H-tetracene-5,12-dione
SpectraBase Compound ID q6QavjDzZa
InChI InChI=1S/C21H20O7/c1-9(22)21(27)7-6-10-12(8-21)19(25)15-16(17(10)23)20(26)14-11(18(15)24)4-3-5-13(14)28-2/h3-5,9,22-23,25,27H,6-8H2,1-2H3/t9-,21-/m1/s1
InChIKey FCGIQQFXNIJXMK-AOUSDQRYSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JYFGpKcLf9
Name (9R)-4-methoxy-6,9,11-tris(oxidanyl)-9-[(1R)-1-oxidanylethyl]-8,10-dihydro-7H-tetracene-5,12-dione
Alternate Name(s) (9R)-6,9,11-trihydroxy-9-[(1R)-1-hydroxyethyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione (9R)-6,9,11-trihydroxy-9-[(1R)-1-hydroxyethyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone
CAS Registry Number 100992-86-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-9(22)21(27)7-6-10-12(8-21)19(25)15-16(17(10)23)20(26)14-11(18(15)24)4-3-5-13(14)28-2/h3-5,9,22-23,25,27H,6-8H2,1-2H3/t9-,21-/m1/s1
InChIKey FCGIQQFXNIJXMK-AOUSDQRYSA-N
Molecular Weight 384.384 g/mol
SMILES Oc1c2c(c(c3C[C@](CCc13)([C@](O)(C)[H])O)O)C(c1c(C2=O)c(ccc1)OC)=O
SPLASH splash10-0019-0009000000-074e4a4c00d3b517ce33
Source of Spectrum J-55-2530-23
Wiley ID 1361517